4-[5-[(E)-2-cyano-3-oxidanylidene-3-(propan-2-ylamino)prop-1-enyl]furan-2-yl]-3-methyl-benzoic acid

Systemtic Name: 4-[5-[(E)-2-cyano-3-oxidanylidene-3-(propan-2-ylamino)prop-1-enyl]furan-2-yl]-3-methyl-benzoic acid Openeye Name: 4-[5-[(E)-2-cyano-3-(isopropylamino)-3-oxo-prop-1-enyl]-2-furyl]-3-methyl-benzoic acid CAS Name: 4-[5-[(E)-2-cyano-3-oxo-3-(propan-2-ylamino)prop-1-enyl]-2-furanyl]-3-methylbenzoic acid IUPAC Name: 4-[5-[(E)-2-cyano-3-oxo-3-(propan-2-ylamino)prop-1-enyl]furan-2-yl]-3-methylbenzoic acid Traditional Name: 4-[5-[(E)-2-cyano-3-(isopropylamino)-3-keto-prop-1-enyl]-2-furyl]-3-methyl-benzoic acid Formula: C19H18N2O4 MolecularWeight: 338.35722

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H18N2O4/c1-11(2)21-18(22)14(10-20)9-15-5-7-17(25-15)16-6-4-13(19(23)24)8-12(16)3/h4-9,11H,1-3H3,(H,21,22)(H,23,24)/b14-9+