methyl (4Z)-2-methyl-1-(2-methylpropyl)-5-oxidanylidene-4-[(3-phenoxyphenyl)methylidene]pyrrole-3-carboxylate

Systemtic Name: methyl (4Z)-2-methyl-1-(2-methylpropyl)-5-oxidanylidene-4-[(3-phenoxyphenyl)methylidene]pyrrole-3-carboxylate Openeye Name: methyl (4Z)-1-isobutyl-2-methyl-5-oxo-4-[(3-phenoxyphenyl)methylene]pyrrole-3-carboxylate CAS Name: (4Z)-2-methyl-1-(2-methylpropyl)-5-oxo-4-[(3-phenoxyphenyl)methylidene]-3-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl (4Z)-2-methyl-1-(2-methylpropyl)-5-oxo-4-[(3-phenoxyphenyl)methylidene]pyrrole-3-carboxylate Traditional Name: (4Z)-1-isobutyl-5-keto-2-methyl-4-(3-phenoxybenzylidene)-2-pyrroline-3-carboxylic acid methyl ester Formula: C24H25NO4 MolecularWeight: 391.4596

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC2=CC(=CC=C2)OC3=CC=CC=C3)C(=O)N1CC(C)C)C(=O)OC

Isomeric SMILES

CC1=C(/C(=C/C2=CC(=CC=C2)OC3=CC=CC=C3)/C(=O)N1CC(C)C)C(=O)OC

InChI

InChI=1S/C24H25NO4/c1-16(2)15-25-17(3)22(24(27)28-4)21(23(25)26)14-18-9-8-12-20(13-18)29-19-10-6-5-7-11-19/h5-14,16H,15H2,1-4H3/b21-14-