[2-[(4-bromophenyl)amino]-2-oxidanylidene-ethyl] 1-[(3-methylphenyl)carbonylamino]-5-oxidanylidene-pyrrolidine-3-carboxylate

Systemtic Name: [2-[(4-bromophenyl)amino]-2-oxidanylidene-ethyl] 1-[(3-methylphenyl)carbonylamino]-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: [2-(4-bromoanilino)-2-oxo-ethyl] 1-[(3-methylbenzoyl)amino]-5-oxo-pyrrolidine-3-carboxylate CAS Name: 1-[[(3-methylphenyl)-oxomethyl]amino]-5-oxo-3-pyrrolidinecarboxylic acid [2-(4-bromoanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-bromoanilino)-2-oxoethyl] 1-[(3-methylbenzoyl)amino]-5-oxopyrrolidine-3-carboxylate Traditional Name: 5-keto-1-(m-toluoylamino)pyrrolidine-3-carboxylic acid [2-(4-bromoanilino)-2-keto-ethyl] ester Formula: C21H20BrN3O5 MolecularWeight: 474.3046

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H20BrN3O5/c1-13-3-2-4-14(9-13)20(28)24-25-11-15(10-19(25)27)21(29)30-12-18(26)23-17-7-5-16(22)6-8-17/h2-9,15H,10-12H2,1H3,(H,23,26)(H,24,28)