3-[[(E)-2-cyano-3-(4-methoxyphenyl)prop-2-enoyl]amino]benzoic acid

Systemtic Name: 3-[[(E)-2-cyano-3-(4-methoxyphenyl)prop-2-enoyl]amino]benzoic acid Openeye Name: 3-[[(E)-2-cyano-3-(4-methoxyphenyl)prop-2-enoyl]amino]benzoic acid CAS Name: 3-[[(E)-2-cyano-3-(4-methoxyphenyl)-1-oxoprop-2-enyl]amino]benzoic acid IUPAC Name: 3-[[(E)-2-cyano-3-(4-methoxyphenyl)prop-2-enoyl]amino]benzoic acid Traditional Name: 3-[[(E)-2-cyano-3-(4-methoxyphenyl)acryloyl]amino]benzoic acid Formula: C18H14N2O4 MolecularWeight: 322.31476

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C=C(C#N)C(=O)NC2=CC=CC(=C2)C(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)/C=C(\C#N)/C(=O)NC2=CC=CC(=C2)C(=O)O

InChI

InChI=1S/C18H14N2O4/c1-24-16-7-5-12(6-8-16)9-14(11-19)17(21)20-15-4-2-3-13(10-15)18(22)23/h2-10H,1H3,(H,20,21)(H,22,23)/b14-9+