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

Systemtic Name: 2-[[(E)-2-cyano-3-(4-methoxycarbonylphenyl)prop-2-enoyl]amino]benzoic acid Openeye Name: 2-[[(E)-2-cyano-3-(4-methoxycarbonylphenyl)prop-2-enoyl]amino]benzoic acid CAS Name: 2-[[(E)-2-cyano-3-(4-methoxycarbonylphenyl)-1-oxoprop-2-enyl]amino]benzoic acid IUPAC Name: 2-[[(E)-2-cyano-3-(4-methoxycarbonylphenyl)prop-2-enoyl]amino]benzoic acid Traditional Name: 2-[[(E)-3-(4-carbomethoxyphenyl)-2-cyano-acryloyl]amino]benzoic acid Formula: C19H14N2O5 MolecularWeight: 350.32486

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C=C(C#N)C(=O)NC2=CC=CC=C2C(=O)O

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)/C=C(\C#N)/C(=O)NC2=CC=CC=C2C(=O)O

InChI

InChI=1S/C19H14N2O5/c1-26-19(25)13-8-6-12(7-9-13)10-14(11-20)17(22)21-16-5-3-2-4-15(16)18(23)24/h2-10H,1H3,(H,21,22)(H,23,24)/b14-10+