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

Systemtic Name: [2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl] 1-[(2-nitrophenyl)carbonylamino]-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: [2-(4-bromo-2-methyl-anilino)-2-oxo-ethyl] 1-[(2-nitrobenzoyl)amino]-5-oxo-pyrrolidine-3-carboxylate CAS Name: 1-[[(2-nitrophenyl)-oxomethyl]amino]-5-oxo-3-pyrrolidinecarboxylic acid [2-(4-bromo-2-methylanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-bromo-2-methylanilino)-2-oxoethyl] 1-[(2-nitrobenzoyl)amino]-5-oxopyrrolidine-3-carboxylate Traditional Name: 5-keto-1-[(2-nitrobenzoyl)amino]pyrrolidine-3-carboxylic acid [2-(4-bromo-2-methyl-anilino)-2-keto-ethyl] ester Formula: C21H19BrN4O7 MolecularWeight: 519.30216

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)COC(=O)C2CC(=O)N(C2)NC(=O)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)COC(=O)C2CC(=O)N(C2)NC(=O)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C21H19BrN4O7/c1-12-8-14(22)6-7-16(12)23-18(27)11-33-21(30)13-9-19(28)25(10-13)24-20(29)15-4-2-3-5-17(15)26(31)32/h2-8,13H,9-11H2,1H3,(H,23,27)(H,24,29)