methyl 1-(2-bromophenyl)carbonyl-5-[(4-methylphenyl)methylcarbamoyl]-2-(2-nitrophenyl)pyrrolidine-3-carboxylate

Systemtic Name: methyl 1-(2-bromophenyl)carbonyl-5-[(4-methylphenyl)methylcarbamoyl]-2-(2-nitrophenyl)pyrrolidine-3-carboxylate Openeye Name: methyl 1-(2-bromobenzoyl)-2-(2-nitrophenyl)-5-(p-tolylmethylcarbamoyl)pyrrolidine-3-carboxylate CAS Name: 1-[(2-bromophenyl)-oxomethyl]-5-[[(4-methylphenyl)methylamino]-oxomethyl]-2-(2-nitrophenyl)-3-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl 1-(2-bromobenzoyl)-5-[(4-methylphenyl)methylcarbamoyl]-2-(2-nitrophenyl)pyrrolidine-3-carboxylate Traditional Name: 1-(2-bromobenzoyl)-5-[(4-methylbenzyl)carbamoyl]-2-(2-nitrophenyl)pyrrolidine-3-carboxylic acid methyl ester Formula: C28H26BrN3O6 MolecularWeight: 580.42654

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)C2CC(C(N2C(=O)C3=CC=CC=C3Br)C4=CC=CC=C4[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)C2CC(C(N2C(=O)C3=CC=CC=C3Br)C4=CC=CC=C4[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C28H26BrN3O6/c1-17-11-13-18(14-12-17)16-30-26(33)24-15-21(28(35)38-2)25(20-8-4-6-10-23(20)32(36)37)31(24)27(34)19-7-3-5-9-22(19)29/h3-14,21,24-25H,15-16H2,1-2H3,(H,30,33)