4-[1,3-benzodioxol-5-yl(1,4-diazepan-1-yl)methyl]-N,N-dimethyl-aniline

Systemtic Name: 4-[1,3-benzodioxol-5-yl(1,4-diazepan-1-yl)methyl]-N,N-dimethyl-aniline Openeye Name: 4-[1,3-benzodioxol-5-yl(1,4-diazepan-1-yl)methyl]-N,N-dimethyl-aniline CAS Name: 4-[1,3-benzodioxol-5-yl(1,4-diazepan-1-yl)methyl]-N,N-dimethylaniline IUPAC Name: 4-[1,3-benzodioxol-5-yl(1,4-diazepan-1-yl)methyl]-N,N-dimethylaniline Traditional Name: [4-[1,3-benzodioxol-5-yl(1,4-diazepan-1-yl)methyl]phenyl]-dimethyl-amine Formula: C21H27N3O2 MolecularWeight: 353.45798

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H27N3O2/c1-23(2)18-7-4-16(5-8-18)21(24-12-3-10-22-11-13-24)17-6-9-19-20(14-17)26-15-25-19/h4-9,14,21-22H,3,10-13,15H2,1-2H3