(E)-but-2-enedioic acid,N-propan-2-yl-2-[4-(spiro[1,3-dioxolane-2,11'-6H-benzo[c][1]benzoxepine]-4-ylmethyl)piperazin-1-yl]acetamide
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![(E)-but-2-enedioic acid,N-propan-2-yl-2-[4-(spiro[1,3-dioxolane-2,11'-6H-benzo[c][1]benzoxepine]-4-ylmethyl)piperazin-1-yl]acetamide structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/4024d8024aa74089acc562ce97cd911a.png "(E)-but-2-enedioic acid,N-propan-2-yl-2-[4-(spiro[1,3-dioxolane-2,11'-6H-benzo[c][1]benzoxepine]-4-ylmethyl)piperazin-1-yl]acetamide")
(E)-but-2-enedioic acid,N-propan-2-yl-2-[4-(spiro[1,3-dioxolane-2,11'-6H-benzo[c][1]benzoxepine]-4-ylmethyl)piperazin-1-yl]acetamide
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CAS No:
39890-24-9
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Formula:
C34H41N3O12
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Chemical Name:
(E)-but-2-enedioic acid,N-propan-2-yl-2-[4-(spiro[1,3-dioxolane-2,11'-6H-benzo[c][1]benzoxepine]-4-ylmethyl)piperazin-1-yl]acetamide
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Synonyms:
Spiro(dibenz(b,e)oxepin-11,2'-(1',3')dioxolane),6,11-dihydro-4'-(4-(isopropylcarbamoylmethyl)piperazinyl)methyl-,dimaleate; N-propan-2-yl-2-[4-(spiro[1,3-dioxolane-2,11'-6H-benzo[c][1]benzoxepine]-4-ylmethyl)piperazin-1-yl]acetamide;
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CAS No:
(E)-but-2-enedioic acid,N-propan-2-yl-2-[4-(spiro[1,3-dioxolane-2,11'-6H-benzo[c][1]benzoxepine]-4-ylmethyl)piperazin-1-yl]acetamide Basic Attributes
683.70200
683.26902375
Computed Properties
Molecular Weight:683.7
Hydrogen Bond Donor Count:5
Hydrogen Bond Acceptor Count:14
Rotatable Bond Count:9
Exact Mass:683.26902375
Monoisotopic Mass:683.26902375
Topological Polar Surface Area:213
Heavy Atom Count:49
Complexity:787
Undefined Atom Stereocenter Count:2
Defined Bond Stereocenter Count:2
Covalently-Bonded Unit Count:3
Compound Is Canonicalized:Yes
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