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

Systemtic Name: 1,4-bis[(4-methoxyphenyl)methyl]-6-(pyridin-3-ylmethoxy)-1,4-diazepan-2-one Openeye Name: 1,4-bis[(4-methoxyphenyl)methyl]-6-(3-pyridylmethoxy)-1,4-diazepan-2-one CAS Name: 1,4-bis[(4-methoxyphenyl)methyl]-6-(3-pyridinylmethoxy)-1,4-diazepan-2-one IUPAC Name: 1,4-bis[(4-methoxyphenyl)methyl]-6-(pyridin-3-ylmethoxy)-1,4-diazepan-2-one Traditional Name: 1,4-bis(p-anisyl)-6-(3-pyridylmethoxy)-1,4-diazepan-2-one Formula: C27H31N3O4 MolecularWeight: 461.55274

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2CC(CN(C(=O)C2)CC3=CC=C(C=C3)OC)OCC4=CN=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)CN2CC(CN(C(=O)C2)CC3=CC=C(C=C3)OC)OCC4=CN=CC=C4

InChI

InChI=1S/C27H31N3O4/c1-32-24-9-5-21(6-10-24)15-29-17-26(34-20-23-4-3-13-28-14-23)18-30(27(31)19-29)16-22-7-11-25(33-2)12-8-22/h3-14,26H,15-20H2,1-2H3