(2S)-N-[(4-azanylcyclohexyl)methyl]-1-[(2R)-2-azanyl-3-phenyl-propanoyl]pyrrolidine-2-carboxamide

Systemtic Name: (2S)-N-[(4-azanylcyclohexyl)methyl]-1-[(2R)-2-azanyl-3-phenyl-propanoyl]pyrrolidine-2-carboxamide Openeye Name: (2S)-N-[(4-aminocyclohexyl)methyl]-1-[(2R)-2-amino-3-phenyl-propanoyl]pyrrolidine-2-carboxamide CAS Name: (2S)-N-[(4-aminocyclohexyl)methyl]-1-[(2R)-2-amino-1-oxo-3-phenylpropyl]-2-pyrrolidinecarboxamide IUPAC Name: (2S)-N-[(4-aminocyclohexyl)methyl]-1-[(2R)-2-amino-3-phenylpropanoyl]pyrrolidine-2-carboxamide Traditional Name: (2S)-N-[(4-aminocyclohexyl)methyl]-1-[(2R)-2-amino-3-phenyl-propanoyl]pyrrolidine-2-carboxamide Formula: C21H32N4O2 MolecularWeight: 372.50438

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C(CC2=CC=CC=C2)N)C(=O)NCC3CCC(CC3)N

Isomeric SMILES

C1C[C@H](N(C1)C(=O)[C@@H](CC2=CC=CC=C2)N)C(=O)NCC3CCC(CC3)N

InChI

InChI=1S/C21H32N4O2/c22-17-10-8-16(9-11-17)14-24-20(26)19-7-4-12-25(19)21(27)18(23)13-15-5-2-1-3-6-15/h1-3,5-6,16-19H,4,7-14,22-23H2,(H,24,26)/t16?,17?,18-,19+/m1/s1