3-[3,4-bis(oxidanyl)phenyl]-N-[(4-chlorophenyl)methyl]-2-cyano-prop-2-enamide

Systemtic Name: 3-[3,4-bis(oxidanyl)phenyl]-N-[(4-chlorophenyl)methyl]-2-cyano-prop-2-enamide Openeye Name: N-[(4-chlorophenyl)methyl]-2-cyano-3-(3,4-dihydroxyphenyl)prop-2-enamide CAS Name: N-[(4-chlorophenyl)methyl]-2-cyano-3-(3,4-dihydroxyphenyl)-2-propenamide IUPAC Name: N-[(4-chlorophenyl)methyl]-2-cyano-3-(3,4-dihydroxyphenyl)prop-2-enamide Traditional Name: N-(4-chlorobenzyl)-2-cyano-3-(3,4-dihydroxyphenyl)acrylamide Formula: C17H13ClN2O3 MolecularWeight: 328.74972

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC(=O)C(=CC2=CC(=C(C=C2)O)O)C#N)Cl

Isomeric SMILES

C1=CC(=CC=C1CNC(=O)C(=CC2=CC(=C(C=C2)O)O)C#N)Cl

InChI

InChI=1S/C17H13ClN2O3/c18-14-4-1-11(2-5-14)10-20-17(23)13(9-19)7-12-3-6-15(21)16(22)8-12/h1-8,21-22H,10H2,(H,20,23)