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

Systemtic Name: 4-[(Z)-[4-methoxycarbonyl-5-methyl-1-(2-methylpropyl)-2-oxidanylidene-pyrrol-3-ylidene]methyl]benzoic acid Openeye Name: 4-[(Z)-(1-isobutyl-4-methoxycarbonyl-5-methyl-2-oxo-pyrrol-3-ylidene)methyl]benzoic acid CAS Name: 4-[(Z)-[4-methoxycarbonyl-5-methyl-1-(2-methylpropyl)-2-oxo-3-pyrrolylidene]methyl]benzoic acid IUPAC Name: 4-[(Z)-[4-methoxycarbonyl-5-methyl-1-(2-methylpropyl)-2-oxopyrrol-3-ylidene]methyl]benzoic acid Traditional Name: 4-[(Z)-(4-carbomethoxy-1-isobutyl-2-keto-5-methyl-2-pyrrolin-3-ylidene)methyl]benzoic acid Formula: C19H21NO5 MolecularWeight: 343.37374

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC2=CC=C(C=C2)C(=O)O)C(=O)N1CC(C)C)C(=O)OC

Isomeric SMILES

CC1=C(/C(=C/C2=CC=C(C=C2)C(=O)O)/C(=O)N1CC(C)C)C(=O)OC

InChI

InChI=1S/C19H21NO5/c1-11(2)10-20-12(3)16(19(24)25-4)15(17(20)21)9-13-5-7-14(8-6-13)18(22)23/h5-9,11H,10H2,1-4H3,(H,22,23)/b15-9-