1-cyclohexyl-4-[2-(2,5-dimethoxyphenyl)ethanoyl]-6-(pyridin-3-ylmethoxy)-1,4-diazepan-2-one

Systemtic Name: 1-cyclohexyl-4-[2-(2,5-dimethoxyphenyl)ethanoyl]-6-(pyridin-3-ylmethoxy)-1,4-diazepan-2-one Openeye Name: 1-cyclohexyl-4-[2-(2,5-dimethoxyphenyl)acetyl]-6-(3-pyridylmethoxy)-1,4-diazepan-2-one CAS Name: 1-cyclohexyl-4-[2-(2,5-dimethoxyphenyl)-1-oxoethyl]-6-(3-pyridinylmethoxy)-1,4-diazepan-2-one IUPAC Name: 1-cyclohexyl-4-[2-(2,5-dimethoxyphenyl)acetyl]-6-(pyridin-3-ylmethoxy)-1,4-diazepan-2-one Traditional Name: 1-cyclohexyl-4-[2-(2,5-dimethoxyphenyl)acetyl]-6-(3-pyridylmethoxy)-1,4-diazepan-2-one Formula: C27H35N3O5 MolecularWeight: 481.5839

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)CC(=O)N2CC(CN(C(=O)C2)C3CCCCC3)OCC4=CN=CC=C4

Isomeric SMILES

COC1=CC(=C(C=C1)OC)CC(=O)N2CC(CN(C(=O)C2)C3CCCCC3)OCC4=CN=CC=C4

InChI

InChI=1S/C27H35N3O5/c1-33-23-10-11-25(34-2)21(13-23)14-26(31)29-16-24(35-19-20-7-6-12-28-15-20)17-30(27(32)18-29)22-8-4-3-5-9-22/h6-7,10-13,15,22,24H,3-5,8-9,14,16-19H2,1-2H3