(2R)-N-(4-acetamidocyclohexyl)-1-(3-bromophenyl)carbonyl-pyrrolidine-2-carboxamide

Systemtic Name: (2R)-N-(4-acetamidocyclohexyl)-1-(3-bromophenyl)carbonyl-pyrrolidine-2-carboxamide Openeye Name: (2R)-N-(4-acetamidocyclohexyl)-1-(3-bromobenzoyl)pyrrolidine-2-carboxamide CAS Name: (2R)-N-(4-acetamidocyclohexyl)-1-[(3-bromophenyl)-oxomethyl]-2-pyrrolidinecarboxamide IUPAC Name: (2R)-N-(4-acetamidocyclohexyl)-1-(3-bromobenzoyl)pyrrolidine-2-carboxamide Traditional Name: (2R)-N-(4-acetamidocyclohexyl)-1-(3-bromobenzoyl)pyrrolidine-2-carboxamide Formula: C20H26BrN3O3 MolecularWeight: 436.34274

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1CCC(CC1)NC(=O)C2CCCN2C(=O)C3=CC(=CC=C3)Br

Isomeric SMILES

CC(=O)NC1CCC(CC1)NC(=O)[C@H]2CCCN2C(=O)C3=CC(=CC=C3)Br

InChI

InChI=1S/C20H26BrN3O3/c1-13(25)22-16-7-9-17(10-8-16)23-19(26)18-6-3-11-24(18)20(27)14-4-2-5-15(21)12-14/h2,4-5,12,16-18H,3,6-11H2,1H3,(H,22,25)(H,23,26)/t16?,17?,18-/m1/s1