(2S,4S)-4-[(5-chloranyl-2-oxidanyl-phenyl)methylamino]-N-ethyl-1-(phenylmethyl)pyrrolidine-2-carboxamide

Systemtic Name: (2S,4S)-4-[(5-chloranyl-2-oxidanyl-phenyl)methylamino]-N-ethyl-1-(phenylmethyl)pyrrolidine-2-carboxamide Openeye Name: (2S,4S)-1-benzyl-4-[(5-chloro-2-hydroxy-phenyl)methylamino]-N-ethyl-pyrrolidine-2-carboxamide CAS Name: (2S,4S)-4-[(5-chloro-2-hydroxyphenyl)methylamino]-N-ethyl-1-(phenylmethyl)-2-pyrrolidinecarboxamide IUPAC Name: (2S,4S)-1-benzyl-4-[(5-chloro-2-hydroxyphenyl)methylamino]-N-ethylpyrrolidine-2-carboxamide Traditional Name: (2S,4S)-1-benzyl-4-[(5-chloro-2-hydroxy-benzyl)amino]-N-ethyl-pyrrolidine-2-carboxamide Formula: C21H26ClN3O2 MolecularWeight: 387.90304

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26ClN3O2/c1-2-23-21(27)19-11-18(14-25(19)13-15-6-4-3-5-7-15)24-12-16-10-17(22)8-9-20(16)26/h3-10,18-19,24,26H,2,11-14H2,1H3,(H,23,27)/t18-,19-/m0/s1