(2S)-N-[(4-azanylcyclohexyl)methyl]-N-(3,3-diphenylpropanoyl)pyrrolidine-2-carboxamide

Systemtic Name: (2S)-N-[(4-azanylcyclohexyl)methyl]-N-(3,3-diphenylpropanoyl)pyrrolidine-2-carboxamide Openeye Name: (2S)-N-[(4-aminocyclohexyl)methyl]-N-(3,3-diphenylpropanoyl)pyrrolidine-2-carboxamide CAS Name: (2S)-N-[(4-aminocyclohexyl)methyl]-N-(1-oxo-3,3-diphenylpropyl)-2-pyrrolidinecarboxamide IUPAC Name: (2S)-N-[(4-aminocyclohexyl)methyl]-N-(3,3-diphenylpropanoyl)pyrrolidine-2-carboxamide Traditional Name: (2S)-N-[(4-aminocyclohexyl)methyl]-N-(3,3-diphenylpropanoyl)pyrrolidine-2-carboxamide Formula: C27H35N3O2 MolecularWeight: 433.5857

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(NC1)C(=O)N(CC2CCC(CC2)N)C(=O)CC(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1C[C@H](NC1)C(=O)N(CC2CCC(CC2)N)C(=O)CC(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H35N3O2/c28-23-15-13-20(14-16-23)19-30(27(32)25-12-7-17-29-25)26(31)18-24(21-8-3-1-4-9-21)22-10-5-2-6-11-22/h1-6,8-11,20,23-25,29H,7,12-19,28H2/t20?,23?,25-/m0/s1