[2-[(4-bromanyl-3-chloranyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl] 1-(3-nitrophenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate

Systemtic Name: [2-[(4-bromanyl-3-chloranyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl] 1-(3-nitrophenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: [2-(4-bromo-3-chloro-2-methyl-anilino)-2-oxo-ethyl] 1-(3-nitrophenyl)-5-oxo-pyrrolidine-3-carboxylate CAS Name: 1-(3-nitrophenyl)-5-oxo-3-pyrrolidinecarboxylic acid [2-(4-bromo-3-chloro-2-methylanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-bromo-3-chloro-2-methylanilino)-2-oxoethyl] 1-(3-nitrophenyl)-5-oxopyrrolidine-3-carboxylate Traditional Name: 5-keto-1-(3-nitrophenyl)pyrrolidine-3-carboxylic acid [2-(4-bromo-3-chloro-2-methyl-anilino)-2-keto-ethyl] ester Formula: C20H17BrClN3O6 MolecularWeight: 510.72248

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1Cl)Br)NC(=O)COC(=O)C2CC(=O)N(C2)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1Cl)Br)NC(=O)COC(=O)C2CC(=O)N(C2)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H17BrClN3O6/c1-11-16(6-5-15(21)19(11)22)23-17(26)10-31-20(28)12-7-18(27)24(9-12)13-3-2-4-14(8-13)25(29)30/h2-6,8,12H,7,9-10H2,1H3,(H,23,26)