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

Systemtic Name: methyl (4Z)-4-[(4-bromophenyl)methylidene]-2-methyl-1-(2-methylpropyl)-5-oxidanylidene-pyrrole-3-carboxylate Openeye Name: methyl (4Z)-4-[(4-bromophenyl)methylene]-1-isobutyl-2-methyl-5-oxo-pyrrole-3-carboxylate CAS Name: (4Z)-4-[(4-bromophenyl)methylidene]-2-methyl-1-(2-methylpropyl)-5-oxo-3-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl (4Z)-4-[(4-bromophenyl)methylidene]-2-methyl-1-(2-methylpropyl)-5-oxopyrrole-3-carboxylate Traditional Name: (4Z)-4-(4-bromobenzylidene)-1-isobutyl-5-keto-2-methyl-2-pyrroline-3-carboxylic acid methyl ester Formula: C18H20BrNO3 MolecularWeight: 378.2603

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20BrNO3/c1-11(2)10-20-12(3)16(18(22)23-4)15(17(20)21)9-13-5-7-14(19)8-6-13/h5-9,11H,10H2,1-4H3/b15-9-