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

Systemtic Name: methyl 1-(2-bromophenyl)carbonyl-2,4-diphenyl-5-(propylcarbamoyl)pyrrolidine-3-carboxylate Openeye Name: methyl 1-(2-bromobenzoyl)-2,4-diphenyl-5-(propylcarbamoyl)pyrrolidine-3-carboxylate CAS Name: 1-[(2-bromophenyl)-oxomethyl]-5-[oxo(propylamino)methyl]-2,4-diphenyl-3-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl 1-(2-bromobenzoyl)-2,4-diphenyl-5-(propylcarbamoyl)pyrrolidine-3-carboxylate Traditional Name: 1-(2-bromobenzoyl)-2,4-diphenyl-5-(propylcarbamoyl)pyrrolidine-3-carboxylic acid methyl ester Formula: C29H29BrN2O4 MolecularWeight: 549.45556

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1C(C(C(N1C(=O)C2=CC=CC=C2Br)C3=CC=CC=C3)C(=O)OC)C4=CC=CC=C4

Isomeric SMILES

CCCNC(=O)C1C(C(C(N1C(=O)C2=CC=CC=C2Br)C3=CC=CC=C3)C(=O)OC)C4=CC=CC=C4

InChI

InChI=1S/C29H29BrN2O4/c1-3-18-31-27(33)26-23(19-12-6-4-7-13-19)24(29(35)36-2)25(20-14-8-5-9-15-20)32(26)28(34)21-16-10-11-17-22(21)30/h4-17,23-26H,3,18H2,1-2H3,(H,31,33)