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

Systemtic Name: [2-[(4-bromanyl-3,5-dimethyl-phenyl)amino]-2-oxidanylidene-ethyl] 1-(2,2-diphenylethanoylamino)-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: [2-(4-bromo-3,5-dimethyl-anilino)-2-oxo-ethyl] 1-[(2,2-diphenylacetyl)amino]-5-oxo-pyrrolidine-3-carboxylate CAS Name: 5-oxo-1-[(1-oxo-2,2-diphenylethyl)amino]-3-pyrrolidinecarboxylic acid [2-(4-bromo-3,5-dimethylanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-bromo-3,5-dimethylanilino)-2-oxoethyl] 1-[(2,2-diphenylacetyl)amino]-5-oxopyrrolidine-3-carboxylate Traditional Name: 1-[(2,2-diphenylacetyl)amino]-5-keto-pyrrolidine-3-carboxylic acid [2-(4-bromo-3,5-dimethyl-anilino)-2-keto-ethyl] ester Formula: C29H28BrN3O5 MolecularWeight: 578.45372

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1Br)C)NC(=O)COC(=O)C2CC(=O)N(C2)NC(=O)C(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=CC(=C1Br)C)NC(=O)COC(=O)C2CC(=O)N(C2)NC(=O)C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C29H28BrN3O5/c1-18-13-23(14-19(2)27(18)30)31-24(34)17-38-29(37)22-15-25(35)33(16-22)32-28(36)26(20-9-5-3-6-10-20)21-11-7-4-8-12-21/h3-14,22,26H,15-17H2,1-2H3,(H,31,34)(H,32,36)