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

Systemtic Name: 1-cyclohexyl-6-phenylmethoxy-4-(3-pyridin-2-ylpropanoyl)-1,4-diazepan-2-one Openeye Name: 6-benzyloxy-1-cyclohexyl-4-[3-(2-pyridyl)propanoyl]-1,4-diazepan-2-one CAS Name: 1-cyclohexyl-4-[1-oxo-3-(2-pyridinyl)propyl]-6-phenylmethoxy-1,4-diazepan-2-one IUPAC Name: 1-cyclohexyl-6-phenylmethoxy-4-(3-pyridin-2-ylpropanoyl)-1,4-diazepan-2-one Traditional Name: 6-benzoxy-1-cyclohexyl-4-[3-(2-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=CC=N3)OCC4=CC=CC=C4

Isomeric SMILES

C1CCC(CC1)N2CC(CN(CC2=O)C(=O)CCC3=CC=CC=N3)OCC4=CC=CC=C4

InChI

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