4-[(Z)-(4-methoxycarbonyl-5-methyl-2-oxidanylidene-1-phenyl-pyrrol-3-ylidene)methyl]benzoic acid

Systemtic Name: 4-[(Z)-(4-methoxycarbonyl-5-methyl-2-oxidanylidene-1-phenyl-pyrrol-3-ylidene)methyl]benzoic acid Openeye Name: 4-[(Z)-(4-methoxycarbonyl-5-methyl-2-oxo-1-phenyl-pyrrol-3-ylidene)methyl]benzoic acid CAS Name: 4-[(Z)-(4-methoxycarbonyl-5-methyl-2-oxo-1-phenyl-3-pyrrolylidene)methyl]benzoic acid IUPAC Name: 4-[(Z)-(4-methoxycarbonyl-5-methyl-2-oxo-1-phenylpyrrol-3-ylidene)methyl]benzoic acid Traditional Name: 4-[(Z)-(4-carbomethoxy-2-keto-5-methyl-1-phenyl-2-pyrrolin-3-ylidene)methyl]benzoic acid Formula: C21H17NO5 MolecularWeight: 363.36338

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC2=CC=C(C=C2)C(=O)O)C(=O)N1C3=CC=CC=C3)C(=O)OC

Isomeric SMILES

CC1=C(/C(=C/C2=CC=C(C=C2)C(=O)O)/C(=O)N1C3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C21H17NO5/c1-13-18(21(26)27-2)17(12-14-8-10-15(11-9-14)20(24)25)19(23)22(13)16-6-4-3-5-7-16/h3-12H,1-2H3,(H,24,25)/b17-12-