4-cyclohex-3-en-1-ylcarbonyl-1-[(4-methoxyphenyl)methyl]-6-(pyridin-3-ylmethoxy)-1,4-diazepan-2-one

Systemtic Name: 4-cyclohex-3-en-1-ylcarbonyl-1-[(4-methoxyphenyl)methyl]-6-(pyridin-3-ylmethoxy)-1,4-diazepan-2-one Openeye Name: 4-(cyclohex-3-ene-1-carbonyl)-1-[(4-methoxyphenyl)methyl]-6-(3-pyridylmethoxy)-1,4-diazepan-2-one CAS Name: 4-[1-cyclohex-3-enyl(oxo)methyl]-1-[(4-methoxyphenyl)methyl]-6-(3-pyridinylmethoxy)-1,4-diazepan-2-one IUPAC Name: 4-(cyclohex-3-ene-1-carbonyl)-1-[(4-methoxyphenyl)methyl]-6-(pyridin-3-ylmethoxy)-1,4-diazepan-2-one Traditional Name: 4-(cyclohex-3-ene-1-carbonyl)-1-p-anisyl-6-(3-pyridylmethoxy)-1,4-diazepan-2-one Formula: C26H31N3O4 MolecularWeight: 449.54204

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2CC(CN(CC2=O)C(=O)C3CCC=CC3)OCC4=CN=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)CN2CC(CN(CC2=O)C(=O)C3CCC=CC3)OCC4=CN=CC=C4

InChI

InChI=1S/C26H31N3O4/c1-32-23-11-9-20(10-12-23)15-28-16-24(33-19-21-6-5-13-27-14-21)17-29(18-25(28)30)26(31)22-7-3-2-4-8-22/h2-3,5-6,9-14,22,24H,4,7-8,15-19H2,1H3