methyl 1-(3-bromophenyl)carbonyl-5-(cyclopropylmethylcarbamoyl)-2,4-diphenyl-pyrrolidine-3-carboxylate

Systemtic Name: methyl 1-(3-bromophenyl)carbonyl-5-(cyclopropylmethylcarbamoyl)-2,4-diphenyl-pyrrolidine-3-carboxylate Openeye Name: methyl 1-(3-bromobenzoyl)-5-(cyclopropylmethylcarbamoyl)-2,4-diphenyl-pyrrolidine-3-carboxylate CAS Name: 1-[(3-bromophenyl)-oxomethyl]-5-[(cyclopropylmethylamino)-oxomethyl]-2,4-diphenyl-3-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl 1-(3-bromobenzoyl)-5-(cyclopropylmethylcarbamoyl)-2,4-diphenylpyrrolidine-3-carboxylate Traditional Name: 1-(3-bromobenzoyl)-5-(cyclopropylmethylcarbamoyl)-2,4-diphenyl-pyrrolidine-3-carboxylic acid methyl ester Formula: C30H29BrN2O4 MolecularWeight: 561.46626

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1C(C(N(C1C2=CC=CC=C2)C(=O)C3=CC(=CC=C3)Br)C(=O)NCC4CC4)C5=CC=CC=C5

Isomeric SMILES

COC(=O)C1C(C(N(C1C2=CC=CC=C2)C(=O)C3=CC(=CC=C3)Br)C(=O)NCC4CC4)C5=CC=CC=C5

InChI

InChI=1S/C30H29BrN2O4/c1-37-30(36)25-24(20-9-4-2-5-10-20)27(28(34)32-18-19-15-16-19)33(26(25)21-11-6-3-7-12-21)29(35)22-13-8-14-23(31)17-22/h2-14,17,19,24-27H,15-16,18H2,1H3,(H,32,34)