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

Systemtic Name: methyl (4Z)-4-[(4-bromophenyl)methylidene]-1,2-dimethyl-5-oxidanylidene-pyrrole-3-carboxylate Openeye Name: methyl (4Z)-4-[(4-bromophenyl)methylene]-1,2-dimethyl-5-oxo-pyrrole-3-carboxylate CAS Name: (4Z)-4-[(4-bromophenyl)methylidene]-1,2-dimethyl-5-oxo-3-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl (4Z)-4-[(4-bromophenyl)methylidene]-1,2-dimethyl-5-oxopyrrole-3-carboxylate Traditional Name: (4Z)-4-(4-bromobenzylidene)-5-keto-1,2-dimethyl-2-pyrroline-3-carboxylic acid methyl ester Formula: C15H14BrNO3 MolecularWeight: 336.18056

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC2=CC=C(C=C2)Br)C(=O)N1C)C(=O)OC

Isomeric SMILES

CC1=C(/C(=C/C2=CC=C(C=C2)Br)/C(=O)N1C)C(=O)OC

InChI

InChI=1S/C15H14BrNO3/c1-9-13(15(19)20-3)12(14(18)17(9)2)8-10-4-6-11(16)7-5-10/h4-8H,1-3H3/b12-8-