(2S,4R)-4-[(3-chlorophenyl)methylamino]-1-(phenylmethyl)-N-propan-2-yl-pyrrolidine-2-carboxamide

Systemtic Name: (2S,4R)-4-[(3-chlorophenyl)methylamino]-1-(phenylmethyl)-N-propan-2-yl-pyrrolidine-2-carboxamide Openeye Name: (2S,4R)-1-benzyl-4-[(3-chlorophenyl)methylamino]-N-isopropyl-pyrrolidine-2-carboxamide CAS Name: (2S,4R)-4-[(3-chlorophenyl)methylamino]-1-(phenylmethyl)-N-propan-2-yl-2-pyrrolidinecarboxamide IUPAC Name: (2S,4R)-1-benzyl-4-[(3-chlorophenyl)methylamino]-N-propan-2-ylpyrrolidine-2-carboxamide Traditional Name: (2S,4R)-1-benzyl-4-[(3-chlorobenzyl)amino]-N-isopropyl-pyrrolidine-2-carboxamide Formula: C22H28ClN3O MolecularWeight: 385.93022

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C1CC(CN1CC2=CC=CC=C2)NCC3=CC(=CC=C3)Cl

Isomeric SMILES

CC(C)NC(=O)[C@@H]1C[C@H](CN1CC2=CC=CC=C2)NCC3=CC(=CC=C3)Cl

InChI

InChI=1S/C22H28ClN3O/c1-16(2)25-22(27)21-12-20(24-13-18-9-6-10-19(23)11-18)15-26(21)14-17-7-4-3-5-8-17/h3-11,16,20-21,24H,12-15H2,1-2H3,(H,25,27)/t20-,21+/m1/s1