2-[[(2E,4E)-2-cyano-5-(2-methoxyphenyl)penta-2,4-dienoyl]amino]benzoic acid

Systemtic Name: 2-[[(2E,4E)-2-cyano-5-(2-methoxyphenyl)penta-2,4-dienoyl]amino]benzoic acid Openeye Name: 2-[[(2E,4E)-2-cyano-5-(2-methoxyphenyl)penta-2,4-dienoyl]amino]benzoic acid CAS Name: 2-[[(2E,4E)-2-cyano-5-(2-methoxyphenyl)-1-oxopenta-2,4-dienyl]amino]benzoic acid IUPAC Name: 2-[[(2E,4E)-2-cyano-5-(2-methoxyphenyl)penta-2,4-dienoyl]amino]benzoic acid Traditional Name: 2-[[(2E,4E)-2-cyano-5-(2-methoxyphenyl)penta-2,4-dienoyl]amino]benzoic acid Formula: C20H16N2O4 MolecularWeight: 348.35204

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C=CC=C(C#N)C(=O)NC2=CC=CC=C2C(=O)O

Isomeric SMILES

COC1=CC=CC=C1/C=C/C=C(\C#N)/C(=O)NC2=CC=CC=C2C(=O)O

InChI

InChI=1S/C20H16N2O4/c1-26-18-12-5-2-7-14(18)8-6-9-15(13-21)19(23)22-17-11-4-3-10-16(17)20(24)25/h2-12H,1H3,(H,22,23)(H,24,25)/b8-6+,15-9+