methyl (5Z)-5-[2-(4-bromophenyl)-2-oxidanylidene-ethylidene]-1-(phenylmethyl)pyrrolidine-3-carboxylate

Systemtic Name: methyl (5Z)-5-[2-(4-bromophenyl)-2-oxidanylidene-ethylidene]-1-(phenylmethyl)pyrrolidine-3-carboxylate Openeye Name: methyl (5Z)-1-benzyl-5-[2-(4-bromophenyl)-2-oxo-ethylidene]pyrrolidine-3-carboxylate CAS Name: (5Z)-5-[2-(4-bromophenyl)-2-oxoethylidene]-1-(phenylmethyl)-3-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl (5Z)-1-benzyl-5-[2-(4-bromophenyl)-2-oxoethylidene]pyrrolidine-3-carboxylate Traditional Name: (5Z)-1-benzyl-5-[2-(4-bromophenyl)-2-keto-ethylidene]pyrrolidine-3-carboxylic acid methyl ester Formula: C21H20BrNO3 MolecularWeight: 414.2924

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CC(=CC(=O)C2=CC=C(C=C2)Br)N(C1)CC3=CC=CC=C3

Isomeric SMILES

COC(=O)C1C/C(=C/C(=O)C2=CC=C(C=C2)Br)/N(C1)CC3=CC=CC=C3

InChI

InChI=1S/C21H20BrNO3/c1-26-21(25)17-11-19(12-20(24)16-7-9-18(22)10-8-16)23(14-17)13-15-5-3-2-4-6-15/h2-10,12,17H,11,13-14H2,1H3/b19-12-