1-(1,3-benzodioxol-5-yl)-N-[(2-bromanyl-4,5-dimethoxy-phenyl)methyl]methanamine

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-N-[(2-bromanyl-4,5-dimethoxy-phenyl)methyl]methanamine Openeye Name: 1-(1,3-benzodioxol-5-yl)-N-[(2-bromo-4,5-dimethoxy-phenyl)methyl]methanamine CAS Name: 1-(1,3-benzodioxol-5-yl)-N-[(2-bromo-4,5-dimethoxyphenyl)methyl]methanamine IUPAC Name: 1-(1,3-benzodioxol-5-yl)-N-[(2-bromo-4,5-dimethoxyphenyl)methyl]methanamine Traditional Name: (2-bromo-4,5-dimethoxy-benzyl)-piperonyl-amine Formula: C17H18BrNO4 MolecularWeight: 380.23312

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)CNCC2=CC3=C(C=C2)OCO3)Br)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)CNCC2=CC3=C(C=C2)OCO3)Br)OC

InChI

InChI=1S/C17H18BrNO4/c1-20-15-6-12(13(18)7-16(15)21-2)9-19-8-11-3-4-14-17(5-11)23-10-22-14/h3-7,19H,8-10H2,1-2H3