N-[(3S)-2-oxidanylideneazepan-3-yl]-N-[[4-(pyridin-2-ylmethoxy)phenyl]methyl]cyclohexanecarboxamide

Systemtic Name: N-[(3S)-2-oxidanylideneazepan-3-yl]-N-[[4-(pyridin-2-ylmethoxy)phenyl]methyl]cyclohexanecarboxamide Openeye Name: N-[(3S)-2-oxoazepan-3-yl]-N-[[4-(2-pyridylmethoxy)phenyl]methyl]cyclohexanecarboxamide CAS Name: N-[(3S)-2-oxo-3-azepanyl]-N-[[4-(2-pyridinylmethoxy)phenyl]methyl]cyclohexanecarboxamide IUPAC Name: N-[(3S)-2-oxoazepan-3-yl]-N-[[4-(pyridin-2-ylmethoxy)phenyl]methyl]cyclohexanecarboxamide Traditional Name: N-[(3S)-2-ketoazepan-3-yl]-N-[4-(2-pyridylmethoxy)benzyl]cyclohexanecarboxamide Formula: C26H33N3O3 MolecularWeight: 435.55852

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)N(CC2=CC=C(C=C2)OCC3=CC=CC=N3)C4CCCCNC4=O

Isomeric SMILES

C1CCC(CC1)C(=O)N(CC2=CC=C(C=C2)OCC3=CC=CC=N3)[C@H]4CCCCNC4=O

InChI

InChI=1S/C26H33N3O3/c30-25-24(11-5-7-17-28-25)29(26(31)21-8-2-1-3-9-21)18-20-12-14-23(15-13-20)32-19-22-10-4-6-16-27-22/h4,6,10,12-16,21,24H,1-3,5,7-9,11,17-19H2,(H,28,30)/t24-/m0/s1