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

Systemtic Name: 1-cyclohexyl-6-phenylmethoxy-4-(2-pyridin-3-ylethanoyl)-1,4-diazepan-2-one Openeye Name: 6-benzyloxy-1-cyclohexyl-4-[2-(3-pyridyl)acetyl]-1,4-diazepan-2-one CAS Name: 1-cyclohexyl-4-[1-oxo-2-(3-pyridinyl)ethyl]-6-phenylmethoxy-1,4-diazepan-2-one IUPAC Name: 1-cyclohexyl-6-phenylmethoxy-4-(2-pyridin-3-ylacetyl)-1,4-diazepan-2-one Traditional Name: 6-benzoxy-1-cyclohexyl-4-[2-(3-pyridyl)acetyl]-1,4-diazepan-2-one Formula: C25H31N3O3 MolecularWeight: 421.53194

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2CC(CN(CC2=O)C(=O)CC3=CN=CC=C3)OCC4=CC=CC=C4

Isomeric SMILES

C1CCC(CC1)N2CC(CN(CC2=O)C(=O)CC3=CN=CC=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C25H31N3O3/c29-24(14-21-10-7-13-26-15-21)27-16-23(31-19-20-8-3-1-4-9-20)17-28(25(30)18-27)22-11-5-2-6-12-22/h1,3-4,7-10,13,15,22-23H,2,5-6,11-12,14,16-19H2