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

Systemtic Name: 1-[(4-methoxyphenyl)methyl]-4-(2-pyridin-3-ylethanoyl)-6-(pyridin-4-ylmethoxy)-1,4-diazepan-2-one Openeye Name: 1-[(4-methoxyphenyl)methyl]-4-[2-(3-pyridyl)acetyl]-6-(4-pyridylmethoxy)-1,4-diazepan-2-one CAS Name: 1-[(4-methoxyphenyl)methyl]-4-[1-oxo-2-(3-pyridinyl)ethyl]-6-(pyridin-4-ylmethoxy)-1,4-diazepan-2-one IUPAC Name: 1-[(4-methoxyphenyl)methyl]-4-(2-pyridin-3-ylacetyl)-6-(pyridin-4-ylmethoxy)-1,4-diazepan-2-one Traditional Name: 1-p-anisyl-4-[2-(3-pyridyl)acetyl]-6-(4-pyridylmethoxy)-1,4-diazepan-2-one Formula: C26H28N4O4 MolecularWeight: 460.52492

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2CC(CN(CC2=O)C(=O)CC3=CN=CC=C3)OCC4=CC=NC=C4

Isomeric SMILES

COC1=CC=C(C=C1)CN2CC(CN(CC2=O)C(=O)CC3=CN=CC=C3)OCC4=CC=NC=C4

InChI

InChI=1S/C26H28N4O4/c1-33-23-6-4-20(5-7-23)15-29-16-24(34-19-21-8-11-27-12-9-21)17-30(18-26(29)32)25(31)13-22-3-2-10-28-14-22/h2-12,14,24H,13,15-19H2,1H3