4-[[2-cyano-3-[5-(4-methylphenyl)furan-2-yl]prop-2-enoyl]amino]benzoic acid

Systemtic Name: 4-[[2-cyano-3-[5-(4-methylphenyl)furan-2-yl]prop-2-enoyl]amino]benzoic acid Openeye Name: 4-[[2-cyano-3-[5-(p-tolyl)-2-furyl]prop-2-enoyl]amino]benzoic acid CAS Name: 4-[[2-cyano-3-[5-(4-methylphenyl)-2-furanyl]-1-oxoprop-2-enyl]amino]benzoic acid IUPAC Name: 4-[[2-cyano-3-[5-(4-methylphenyl)furan-2-yl]prop-2-enoyl]amino]benzoic acid Traditional Name: 4-[[2-cyano-3-[5-(p-tolyl)-2-furyl]acryloyl]amino]benzoic acid Formula: C22H16N2O4 MolecularWeight: 372.37344

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC=C(O2)C=C(C#N)C(=O)NC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC=C(O2)C=C(C#N)C(=O)NC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C22H16N2O4/c1-14-2-4-15(5-3-14)20-11-10-19(28-20)12-17(13-23)21(25)24-18-8-6-16(7-9-18)22(26)27/h2-12H,1H3,(H,24,25)(H,26,27)