methyl 4-[(E)-[[1-(4-bromophenyl)-5-oxidanylidene-pyrrolidin-3-yl]carbonylhydrazinylidene]methyl]benzoate

Systemtic Name: methyl 4-[(E)-[[1-(4-bromophenyl)-5-oxidanylidene-pyrrolidin-3-yl]carbonylhydrazinylidene]methyl]benzoate Openeye Name: methyl 4-[(E)-[[1-(4-bromophenyl)-5-oxo-pyrrolidine-3-carbonyl]hydrazono]methyl]benzoate CAS Name: 4-[(E)-[[[1-(4-bromophenyl)-5-oxo-3-pyrrolidinyl]-oxomethyl]hydrazinylidene]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(E)-[[1-(4-bromophenyl)-5-oxopyrrolidine-3-carbonyl]hydrazinylidene]methyl]benzoate Traditional Name: 4-[(E)-[[1-(4-bromophenyl)-5-keto-pyrrolidine-3-carbonyl]hydrazono]methyl]benzoic acid methyl ester Formula: C20H18BrN3O4 MolecularWeight: 444.27862

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C=NNC(=O)C2CC(=O)N(C2)C3=CC=C(C=C3)Br

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)/C=N/NC(=O)C2CC(=O)N(C2)C3=CC=C(C=C3)Br

InChI

InChI=1S/C20H18BrN3O4/c1-28-20(27)14-4-2-13(3-5-14)11-22-23-19(26)15-10-18(25)24(12-15)17-8-6-16(21)7-9-17/h2-9,11,15H,10,12H2,1H3,(H,23,26)/b22-11+