1-cyclohexyl-6-phenylmethoxy-4-(3-pyridin-4-ylpropanoyl)-1,4-diazepan-2-one

Systemtic Name: 1-cyclohexyl-6-phenylmethoxy-4-(3-pyridin-4-ylpropanoyl)-1,4-diazepan-2-one Openeye Name: 6-benzyloxy-1-cyclohexyl-4-[3-(4-pyridyl)propanoyl]-1,4-diazepan-2-one CAS Name: 1-cyclohexyl-4-(1-oxo-3-pyridin-4-ylpropyl)-6-phenylmethoxy-1,4-diazepan-2-one IUPAC Name: 1-cyclohexyl-6-phenylmethoxy-4-(3-pyridin-4-ylpropanoyl)-1,4-diazepan-2-one Traditional Name: 6-benzoxy-1-cyclohexyl-4-[3-(4-pyridyl)propanoyl]-1,4-diazepan-2-one Formula: C26H33N3O3 MolecularWeight: 435.55852

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2CC(CN(CC2=O)C(=O)CCC3=CC=NC=C3)OCC4=CC=CC=C4

Isomeric SMILES

C1CCC(CC1)N2CC(CN(CC2=O)C(=O)CCC3=CC=NC=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C26H33N3O3/c30-25(12-11-21-13-15-27-16-14-21)28-17-24(32-20-22-7-3-1-4-8-22)18-29(26(31)19-28)23-9-5-2-6-10-23/h1,3-4,7-8,13-16,23-24H,2,5-6,9-12,17-20H2