6-(1,4-diazepan-1-yl)-N-[(1R,2R)-2-oxidanyl-1-phenyl-cyclohexyl]pyridine-3-carboxamide

Systemtic Name: 6-(1,4-diazepan-1-yl)-N-[(1R,2R)-2-oxidanyl-1-phenyl-cyclohexyl]pyridine-3-carboxamide Openeye Name: 6-(1,4-diazepan-1-yl)-N-[(1R,2R)-2-hydroxy-1-phenyl-cyclohexyl]pyridine-3-carboxamide CAS Name: 6-(1,4-diazepan-1-yl)-N-[(1R,2R)-2-hydroxy-1-phenylcyclohexyl]-3-pyridinecarboxamide IUPAC Name: 6-(1,4-diazepan-1-yl)-N-[(1R,2R)-2-hydroxy-1-phenylcyclohexyl]pyridine-3-carboxamide Traditional Name: 6-(1,4-diazepan-1-yl)-N-[(1R,2R)-2-hydroxy-1-phenyl-cyclohexyl]nicotinamide Formula: C23H30N4O2 MolecularWeight: 394.5099

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)O)(C2=CC=CC=C2)NC(=O)C3=CN=C(C=C3)N4CCCNCC4

Isomeric SMILES

C1CC[C@]([C@@H](C1)O)(C2=CC=CC=C2)NC(=O)C3=CN=C(C=C3)N4CCCNCC4

InChI

InChI=1S/C23H30N4O2/c28-20-9-4-5-12-23(20,19-7-2-1-3-8-19)26-22(29)18-10-11-21(25-17-18)27-15-6-13-24-14-16-27/h1-3,7-8,10-11,17,20,24,28H,4-6,9,12-16H2,(H,26,29)/t20-,23-/m1/s1