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

Systemtic Name: methyl (4Z)-4-[(3-bromophenyl)methylidene]-2-methyl-1-(3-methylphenyl)-5-oxidanylidene-pyrrole-3-carboxylate Openeye Name: methyl (4Z)-4-[(3-bromophenyl)methylene]-2-methyl-1-(m-tolyl)-5-oxo-pyrrole-3-carboxylate CAS Name: (4Z)-4-[(3-bromophenyl)methylidene]-2-methyl-1-(3-methylphenyl)-5-oxo-3-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl (4Z)-4-[(3-bromophenyl)methylidene]-2-methyl-1-(3-methylphenyl)-5-oxopyrrole-3-carboxylate Traditional Name: (4Z)-4-(3-bromobenzylidene)-5-keto-2-methyl-1-(m-tolyl)-2-pyrroline-3-carboxylic acid methyl ester Formula: C21H18BrNO3 MolecularWeight: 412.27652

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=C(C(=CC3=CC(=CC=C3)Br)C2=O)C(=O)OC)C

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=C(/C(=C/C3=CC(=CC=C3)Br)/C2=O)C(=O)OC)C

InChI

InChI=1S/C21H18BrNO3/c1-13-6-4-9-17(10-13)23-14(2)19(21(25)26-3)18(20(23)24)12-15-7-5-8-16(22)11-15/h4-12H,1-3H3/b18-12-