(2S)-N-[(4-azanylcyclohexyl)methyl]-1-(2,2-diphenylcyclopropyl)carbonyl-pyrrolidine-2-carboxamide

Systemtic Name: (2S)-N-[(4-azanylcyclohexyl)methyl]-1-(2,2-diphenylcyclopropyl)carbonyl-pyrrolidine-2-carboxamide Openeye Name: (2S)-N-[(4-aminocyclohexyl)methyl]-1-(2,2-diphenylcyclopropanecarbonyl)pyrrolidine-2-carboxamide CAS Name: (2S)-N-[(4-aminocyclohexyl)methyl]-1-[(2,2-diphenylcyclopropyl)-oxomethyl]-2-pyrrolidinecarboxamide IUPAC Name: (2S)-N-[(4-aminocyclohexyl)methyl]-1-(2,2-diphenylcyclopropanecarbonyl)pyrrolidine-2-carboxamide Traditional Name: (2S)-N-[(4-aminocyclohexyl)methyl]-1-(2,2-diphenylcyclopropanecarbonyl)pyrrolidine-2-carboxamide Formula: C28H35N3O2 MolecularWeight: 445.5964

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C2CC2(C3=CC=CC=C3)C4=CC=CC=C4)C(=O)NCC5CCC(CC5)N

Isomeric SMILES

C1C[C@H](N(C1)C(=O)C2CC2(C3=CC=CC=C3)C4=CC=CC=C4)C(=O)NCC5CCC(CC5)N

InChI

InChI=1S/C28H35N3O2/c29-23-15-13-20(14-16-23)19-30-26(32)25-12-7-17-31(25)27(33)24-18-28(24,21-8-3-1-4-9-21)22-10-5-2-6-11-22/h1-6,8-11,20,23-25H,7,12-19,29H2,(H,30,32)/t20?,23?,24?,25-/m0/s1