(2S,4R)-4-(cycloheptylamino)-1-(phenylmethyl)-N-propan-2-yl-pyrrolidine-2-carboxamide

Systemtic Name: (2S,4R)-4-(cycloheptylamino)-1-(phenylmethyl)-N-propan-2-yl-pyrrolidine-2-carboxamide Openeye Name: (2S,4R)-1-benzyl-4-(cycloheptylamino)-N-isopropyl-pyrrolidine-2-carboxamide CAS Name: (2S,4R)-4-(cycloheptylamino)-1-(phenylmethyl)-N-propan-2-yl-2-pyrrolidinecarboxamide IUPAC Name: (2S,4R)-1-benzyl-4-(cycloheptylamino)-N-propan-2-ylpyrrolidine-2-carboxamide Traditional Name: (2S,4R)-1-benzyl-4-(cycloheptylamino)-N-isopropyl-pyrrolidine-2-carboxamide Formula: C22H35N3O MolecularWeight: 357.5328

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C1CC(CN1CC2=CC=CC=C2)NC3CCCCCC3

Isomeric SMILES

CC(C)NC(=O)[C@@H]1C[C@H](CN1CC2=CC=CC=C2)NC3CCCCCC3

InChI

InChI=1S/C22H35N3O/c1-17(2)23-22(26)21-14-20(24-19-12-8-3-4-9-13-19)16-25(21)15-18-10-6-5-7-11-18/h5-7,10-11,17,19-21,24H,3-4,8-9,12-16H2,1-2H3,(H,23,26)/t20-,21+/m1/s1