4-(1,3-benzodioxol-4-ylmethyl)-6-(cyclopropylmethoxy)-1-(pyridin-3-ylmethyl)-1,4-diazepan-2-one

Systemtic Name: 4-(1,3-benzodioxol-4-ylmethyl)-6-(cyclopropylmethoxy)-1-(pyridin-3-ylmethyl)-1,4-diazepan-2-one Openeye Name: 4-(1,3-benzodioxol-4-ylmethyl)-6-(cyclopropylmethoxy)-1-(3-pyridylmethyl)-1,4-diazepan-2-one CAS Name: 4-(1,3-benzodioxol-4-ylmethyl)-6-(cyclopropylmethoxy)-1-(3-pyridinylmethyl)-1,4-diazepan-2-one IUPAC Name: 4-(1,3-benzodioxol-4-ylmethyl)-6-(cyclopropylmethoxy)-1-(pyridin-3-ylmethyl)-1,4-diazepan-2-one Traditional Name: 4-(1,3-benzodioxol-4-ylmethyl)-6-(cyclopropylmethoxy)-1-(3-pyridylmethyl)-1,4-diazepan-2-one Formula: C23H27N3O4 MolecularWeight: 409.47818

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1COC2CN(CC(=O)N(C2)CC3=CN=CC=C3)CC4=C5C(=CC=C4)OCO5

Isomeric SMILES

C1CC1COC2CN(CC(=O)N(C2)CC3=CN=CC=C3)CC4=C5C(=CC=C4)OCO5

InChI

InChI=1S/C23H27N3O4/c27-22-14-25(11-19-4-1-5-21-23(19)30-16-29-21)12-20(28-15-17-6-7-17)13-26(22)10-18-3-2-8-24-9-18/h1-5,8-9,17,20H,6-7,10-16H2