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

Systemtic Name: 1-[(4-methoxyphenyl)methyl]-6-(pyridin-3-ylmethoxy)-4-(pyridin-2-ylmethyl)-1,4-diazepan-2-one Openeye Name: 1-[(4-methoxyphenyl)methyl]-6-(3-pyridylmethoxy)-4-(2-pyridylmethyl)-1,4-diazepan-2-one CAS Name: 1-[(4-methoxyphenyl)methyl]-6-(3-pyridinylmethoxy)-4-(2-pyridinylmethyl)-1,4-diazepan-2-one IUPAC Name: 1-[(4-methoxyphenyl)methyl]-6-(pyridin-3-ylmethoxy)-4-(pyridin-2-ylmethyl)-1,4-diazepan-2-one Traditional Name: 1-p-anisyl-6-(3-pyridylmethoxy)-4-(2-pyridylmethyl)-1,4-diazepan-2-one Formula: C25H28N4O3 MolecularWeight: 432.51482

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2CC(CN(CC2=O)CC3=CC=CC=N3)OCC4=CN=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)CN2CC(CN(CC2=O)CC3=CC=CC=N3)OCC4=CN=CC=C4

InChI

InChI=1S/C25H28N4O3/c1-31-23-9-7-20(8-10-23)14-29-17-24(32-19-21-5-4-11-26-13-21)16-28(18-25(29)30)15-22-6-2-3-12-27-22/h2-13,24H,14-19H2,1H3