3-[[(E)-2-cyano-3-[3-ethoxy-4-(naphthalene-1-carbonyloxy)phenyl]prop-2-enoyl]amino]benzoic acid
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![3-[[(E)-2-cyano-3-[3-ethoxy-4-(naphthalene-1-carbonyloxy)phenyl]prop-2-enoyl]amino]benzoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/f9862687037c41c59562be3ce16b79ee.png "3-[[(E)-2-cyano-3-[3-ethoxy-4-(naphthalene-1-carbonyloxy)phenyl]prop-2-enoyl]amino]benzoic acid")
3-[[(E)-2-cyano-3-[3-ethoxy-4-(naphthalene-1-carbonyloxy)phenyl]prop-2-enoyl]amino]benzoic acid
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CAS No:
380474-83-9
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Formula:
C30H22N2O6
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Chemical Name:
3-[[(E)-2-cyano-3-[3-ethoxy-4-(naphthalene-1-carbonyloxy)phenyl]prop-2-enoyl]amino]benzoic acid
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Synonyms:
3-{[(2E)-2-cyano-3-{3-ethoxy-4-[(naphthalen-1-ylcarbonyl)oxy]phenyl}prop-2-enoyl]amino}benzoic acid;ZINC3231311;STL383465;AKOS001009652;3-[[(E)-2-cyano-3-[3-ethoxy-4-(naphthalene-1-carbonyloxy)phenyl]prop-2-enoyl]amino]benzoic acid;380474-83-9
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CAS No:
3-[[(E)-2-cyano-3-[3-ethoxy-4-(naphthalene-1-carbonyloxy)phenyl]prop-2-enoyl]amino]benzoic acid Basic Attributes
506.5 g/mol
506.14778643 g/mol
Computed Properties
Molecular Weight:506.5
XLogP3:6.2
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:9
Exact Mass:506.14778643
Monoisotopic Mass:506.14778643
Topological Polar Surface Area:126
Heavy Atom Count:38
Complexity:938
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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