4-(1,3-benzodioxol-5-ylcarbonyl)-6-[(3-methoxyphenyl)methoxy]-1-(pyridin-2-ylmethyl)-1,4-diazepan-2-one

Systemtic Name: 4-(1,3-benzodioxol-5-ylcarbonyl)-6-[(3-methoxyphenyl)methoxy]-1-(pyridin-2-ylmethyl)-1,4-diazepan-2-one Openeye Name: 4-(1,3-benzodioxole-5-carbonyl)-6-[(3-methoxyphenyl)methoxy]-1-(2-pyridylmethyl)-1,4-diazepan-2-one CAS Name: 4-[1,3-benzodioxol-5-yl(oxo)methyl]-6-[(3-methoxyphenyl)methoxy]-1-(2-pyridinylmethyl)-1,4-diazepan-2-one IUPAC Name: 4-(1,3-benzodioxole-5-carbonyl)-6-[(3-methoxyphenyl)methoxy]-1-(pyridin-2-ylmethyl)-1,4-diazepan-2-one Traditional Name: 6-m-anisyloxy-4-piperonyloyl-1-(2-pyridylmethyl)-1,4-diazepan-2-one Formula: C27H27N3O6 MolecularWeight: 489.51978

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)COC2CN(CC(=O)N(C2)CC3=CC=CC=N3)C(=O)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

COC1=CC=CC(=C1)COC2CN(CC(=O)N(C2)CC3=CC=CC=N3)C(=O)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C27H27N3O6/c1-33-22-7-4-5-19(11-22)17-34-23-14-29(13-21-6-2-3-10-28-21)26(31)16-30(15-23)27(32)20-8-9-24-25(12-20)36-18-35-24/h2-12,23H,13-18H2,1H3