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ethyl 1-[(5-nitro-1H-indol-3-yl)methyl]-4-phenylpiperidin-1-ium-4-carboxylate;chloride

ethyl 1-[(5-nitro-1H-indol-3-yl)methyl]-4-phenylpiperidin-1-ium-4-carboxylate;chloride structure

CAS No:
3414-73-1
Formula:
C23H26ClN3O4
Chemical Name:
ethyl 1-[(5-nitro-1H-indol-3-yl)methyl]-4-phenylpiperidin-1-ium-4-carboxylate;chloride
Synonyms:
3414-73-1;Isonipecotic acid, 1-(5-nitro-3-indolylmethyl)-4-phenyl-, ethyl ester, hydrochloride;N-(5-Nitro-3-indolylmethyl)-1-phenylisonipecotic acid ethyl ester hydrochloride

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ethyl 1-[(5-nitro-1H-indol-3-yl)methyl]-4-phenylpiperidin-1-ium-4-carboxylate;chloride Basic Attributes

Molecular Weight：

443.9 g/mol

Exact Mass：

443.1611840 g/mol

Characteristics

PSA：

92.4 Å²

Computed Properties

Molecular Weight:443.9
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:6
Exact Mass:443.1611840
Monoisotopic Mass:443.1611840
Topological Polar Surface Area:92.4
Heavy Atom Count:31
Complexity:608
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes

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Guide of ethyl 1-[(5-nitro-1H-indol-3-yl)methyl]-4-phenylpiperidin-1-ium-4-carboxylate;chloride

Basic Attributes
Characteristics
Computed Properties
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