3-[5-[(Z)-2-cyano-3-[(2-methylphenyl)amino]-3-oxidanylidene-prop-1-enyl]furan-2-yl]-4-methyl-benzoic acid

Systemtic Name: 3-[5-[(Z)-2-cyano-3-[(2-methylphenyl)amino]-3-oxidanylidene-prop-1-enyl]furan-2-yl]-4-methyl-benzoic acid Openeye Name: 3-[5-[(Z)-2-cyano-3-(2-methylanilino)-3-oxo-prop-1-enyl]-2-furyl]-4-methyl-benzoic acid CAS Name: 3-[5-[(Z)-2-cyano-3-(2-methylanilino)-3-oxoprop-1-enyl]-2-furanyl]-4-methylbenzoic acid IUPAC Name: 3-[5-[(Z)-2-cyano-3-(2-methylanilino)-3-oxoprop-1-enyl]furan-2-yl]-4-methylbenzoic acid Traditional Name: 3-[5-[(Z)-2-cyano-3-keto-3-(o-toluidino)prop-1-enyl]-2-furyl]-4-methyl-benzoic acid Formula: C23H18N2O4 MolecularWeight: 386.40002

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)O)C2=CC=C(O2)C=C(C#N)C(=O)NC3=CC=CC=C3C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)O)C2=CC=C(O2)/C=C(/C#N)\C(=O)NC3=CC=CC=C3C

InChI

InChI=1S/C23H18N2O4/c1-14-7-8-16(23(27)28)12-19(14)21-10-9-18(29-21)11-17(13-24)22(26)25-20-6-4-3-5-15(20)2/h3-12H,1-2H3,(H,25,26)(H,27,28)/b17-11-