[2-[(4-bromanyl-2,3-dimethyl-phenyl)amino]-2-oxidanylidene-ethyl] 1-[(4-methylphenyl)carbonylamino]-5-oxidanylidene-pyrrolidine-3-carboxylate

Systemtic Name: [2-[(4-bromanyl-2,3-dimethyl-phenyl)amino]-2-oxidanylidene-ethyl] 1-[(4-methylphenyl)carbonylamino]-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: [2-(4-bromo-2,3-dimethyl-anilino)-2-oxo-ethyl] 1-[(4-methylbenzoyl)amino]-5-oxo-pyrrolidine-3-carboxylate CAS Name: 1-[[(4-methylphenyl)-oxomethyl]amino]-5-oxo-3-pyrrolidinecarboxylic acid [2-(4-bromo-2,3-dimethylanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-bromo-2,3-dimethylanilino)-2-oxoethyl] 1-[(4-methylbenzoyl)amino]-5-oxopyrrolidine-3-carboxylate Traditional Name: 5-keto-1-(p-toluoylamino)pyrrolidine-3-carboxylic acid [2-(4-bromo-2,3-dimethyl-anilino)-2-keto-ethyl] ester Formula: C23H24BrN3O5 MolecularWeight: 502.35776

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NN2CC(CC2=O)C(=O)OCC(=O)NC3=C(C(=C(C=C3)Br)C)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NN2CC(CC2=O)C(=O)OCC(=O)NC3=C(C(=C(C=C3)Br)C)C

InChI

InChI=1S/C23H24BrN3O5/c1-13-4-6-16(7-5-13)22(30)26-27-11-17(10-21(27)29)23(31)32-12-20(28)25-19-9-8-18(24)14(2)15(19)3/h4-9,17H,10-12H2,1-3H3,(H,25,28)(H,26,30)