2-thiophen-2-ylethyl (Z)-3-[3,4-bis(oxidanyl)phenyl]-2-cyano-prop-2-enoate

Systemtic Name: 2-thiophen-2-ylethyl (Z)-3-[3,4-bis(oxidanyl)phenyl]-2-cyano-prop-2-enoate Openeye Name: 2-(2-thienyl)ethyl (Z)-2-cyano-3-(3,4-dihydroxyphenyl)prop-2-enoate CAS Name: (Z)-2-cyano-3-(3,4-dihydroxyphenyl)-2-propenoic acid 2-thiophen-2-ylethyl ester IUPAC Name: 2-thiophen-2-ylethyl (Z)-2-cyano-3-(3,4-dihydroxyphenyl)prop-2-enoate Traditional Name: (Z)-2-cyano-3-(3,4-dihydroxyphenyl)acrylic acid 2-(2-thienyl)ethyl ester Formula: C16H13NO4S MolecularWeight: 315.34372

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)CCOC(=O)C(=CC2=CC(=C(C=C2)O)O)C#N

Isomeric SMILES

C1=CSC(=C1)CCOC(=O)/C(=C\C2=CC(=C(C=C2)O)O)/C#N

InChI

InChI=1S/C16H13NO4S/c17-10-12(8-11-3-4-14(18)15(19)9-11)16(20)21-6-5-13-2-1-7-22-13/h1-4,7-9,18-19H,5-6H2/b12-8-