1-[1,3-benzodioxol-5-yl-(3-methylpyridin-4-yl)methyl]-1,4-diazepane

Systemtic Name: 1-[1,3-benzodioxol-5-yl-(3-methylpyridin-4-yl)methyl]-1,4-diazepane Openeye Name: 1-[1,3-benzodioxol-5-yl-(3-methyl-4-pyridyl)methyl]-1,4-diazepane CAS Name: 1-[1,3-benzodioxol-5-yl-(3-methyl-4-pyridinyl)methyl]-1,4-diazepane IUPAC Name: 1-[1,3-benzodioxol-5-yl-(3-methylpyridin-4-yl)methyl]-1,4-diazepane Traditional Name: 1-[1,3-benzodioxol-5-yl-(3-methyl-4-pyridyl)methyl]-1,4-diazepane Formula: C19H23N3O2 MolecularWeight: 325.40482

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CN=C1)C(C2=CC3=C(C=C2)OCO3)N4CCCNCC4

Isomeric SMILES

CC1=C(C=CN=C1)C(C2=CC3=C(C=C2)OCO3)N4CCCNCC4

InChI

InChI=1S/C19H23N3O2/c1-14-12-21-7-5-16(14)19(22-9-2-6-20-8-10-22)15-3-4-17-18(11-15)24-13-23-17/h3-5,7,11-12,19-20H,2,6,8-10,13H2,1H3