4-(1,3-benzodioxol-5-yl)-2-methyl-butane-1,2-diamine

Systemtic Name: 4-(1,3-benzodioxol-5-yl)-2-methyl-butane-1,2-diamine Openeye Name: 4-(1,3-benzodioxol-5-yl)-2-methyl-butane-1,2-diamine CAS Name: 4-(1,3-benzodioxol-5-yl)-2-methylbutane-1,2-diamine IUPAC Name: 4-(1,3-benzodioxol-5-yl)-2-methylbutane-1,2-diamine Traditional Name: [2-amino-4-(1,3-benzodioxol-5-yl)-2-methyl-butyl]amine Formula: C12H18N2O2 MolecularWeight: 222.28352

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC2=C(C=C1)OCO2)(CN)N

Isomeric SMILES

CC(CCC1=CC2=C(C=C1)OCO2)(CN)N

InChI

InChI=1S/C12H18N2O2/c1-12(14,7-13)5-4-9-2-3-10-11(6-9)16-8-15-10/h2-3,6H,4-5,7-8,13-14H2,1H3