diethyl 2-[[1-(3-bromophenyl)-5-oxidanylidene-pyrrolidin-3-yl]carbonylamino]propanedioate

Systemtic Name: diethyl 2-[[1-(3-bromophenyl)-5-oxidanylidene-pyrrolidin-3-yl]carbonylamino]propanedioate Openeye Name: diethyl 2-[[1-(3-bromophenyl)-5-oxo-pyrrolidine-3-carbonyl]amino]propanedioate CAS Name: 2-[[[1-(3-bromophenyl)-5-oxo-3-pyrrolidinyl]-oxomethyl]amino]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[[1-(3-bromophenyl)-5-oxopyrrolidine-3-carbonyl]amino]propanedioate Traditional Name: 2-[[1-(3-bromophenyl)-5-keto-pyrrolidine-3-carbonyl]amino]malonic acid diethyl ester Formula: C18H21BrN2O6 MolecularWeight: 441.27314

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(=O)OCC)NC(=O)C1CC(=O)N(C1)C2=CC(=CC=C2)Br

Isomeric SMILES

CCOC(=O)C(C(=O)OCC)NC(=O)C1CC(=O)N(C1)C2=CC(=CC=C2)Br

InChI

InChI=1S/C18H21BrN2O6/c1-3-26-17(24)15(18(25)27-4-2)20-16(23)11-8-14(22)21(10-11)13-7-5-6-12(19)9-13/h5-7,9,11,15H,3-4,8,10H2,1-2H3,(H,20,23)