1-(7-bromanyl-1,3-benzodioxol-5-yl)-N-butyl-N-methyl-ethane-1,2-diamine

Systemtic Name: 1-(7-bromanyl-1,3-benzodioxol-5-yl)-N-butyl-N-methyl-ethane-1,2-diamine Openeye Name: 1-(7-bromo-1,3-benzodioxol-5-yl)-N-butyl-N-methyl-ethane-1,2-diamine CAS Name: 1-(7-bromo-1,3-benzodioxol-5-yl)-N-butyl-N-methylethane-1,2-diamine IUPAC Name: 1-(7-bromo-1,3-benzodioxol-5-yl)-N-butyl-N-methylethane-1,2-diamine Traditional Name: [2-amino-1-(7-bromo-1,3-benzodioxol-5-yl)ethyl]-butyl-methyl-amine Formula: C14H21BrN2O2 MolecularWeight: 329.23274

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C)C(CN)C1=CC2=C(C(=C1)Br)OCO2

Isomeric SMILES

CCCCN(C)C(CN)C1=CC2=C(C(=C1)Br)OCO2

InChI

InChI=1S/C14H21BrN2O2/c1-3-4-5-17(2)12(8-16)10-6-11(15)14-13(7-10)18-9-19-14/h6-7,12H,3-5,8-9,16H2,1-2H3