(2S)-1-[(3R)-3-azanyl-4-phenyl-butanoyl]-N-(phenylmethyl)pyrrolidine-2-carboxamide

Systemtic Name: (2S)-1-[(3R)-3-azanyl-4-phenyl-butanoyl]-N-(phenylmethyl)pyrrolidine-2-carboxamide Openeye Name: (2S)-1-[(3R)-3-amino-4-phenyl-butanoyl]-N-benzyl-pyrrolidine-2-carboxamide CAS Name: (2S)-1-[(3R)-3-amino-1-oxo-4-phenylbutyl]-N-(phenylmethyl)-2-pyrrolidinecarboxamide IUPAC Name: (2S)-1-[(3R)-3-amino-4-phenylbutanoyl]-N-benzylpyrrolidine-2-carboxamide Traditional Name: (2S)-1-[(3R)-3-amino-4-phenyl-butanoyl]-N-benzyl-pyrrolidine-2-carboxamide Formula: C22H27N3O2 MolecularWeight: 365.46868

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)CC(CC2=CC=CC=C2)N)C(=O)NCC3=CC=CC=C3

Isomeric SMILES

C1C[C@H](N(C1)C(=O)C[C@@H](CC2=CC=CC=C2)N)C(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C22H27N3O2/c23-19(14-17-8-3-1-4-9-17)15-21(26)25-13-7-12-20(25)22(27)24-16-18-10-5-2-6-11-18/h1-6,8-11,19-20H,7,12-16,23H2,(H,24,27)/t19-,20+/m1/s1