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

Systemtic Name: 1-[(4-methoxyphenyl)methyl]-4-(3-phenoxypropanoyl)-6-(pyridin-3-ylmethoxy)-1,4-diazepan-2-one Openeye Name: 1-[(4-methoxyphenyl)methyl]-4-(3-phenoxypropanoyl)-6-(3-pyridylmethoxy)-1,4-diazepan-2-one CAS Name: 1-[(4-methoxyphenyl)methyl]-4-(1-oxo-3-phenoxypropyl)-6-(3-pyridinylmethoxy)-1,4-diazepan-2-one IUPAC Name: 1-[(4-methoxyphenyl)methyl]-4-(3-phenoxypropanoyl)-6-(pyridin-3-ylmethoxy)-1,4-diazepan-2-one Traditional Name: 1-p-anisyl-4-(3-phenoxypropanoyl)-6-(3-pyridylmethoxy)-1,4-diazepan-2-one Formula: C28H31N3O5 MolecularWeight: 489.56284

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2CC(CN(CC2=O)C(=O)CCOC3=CC=CC=C3)OCC4=CN=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)CN2CC(CN(CC2=O)C(=O)CCOC3=CC=CC=C3)OCC4=CN=CC=C4

InChI

InChI=1S/C28H31N3O5/c1-34-24-11-9-22(10-12-24)17-30-18-26(36-21-23-6-5-14-29-16-23)19-31(20-28(30)33)27(32)13-15-35-25-7-3-2-4-8-25/h2-12,14,16,26H,13,15,17-21H2,1H3