N-[(6-bromanyl-1,3-benzodioxol-5-yl)methyl]-3-methyl-butan-1-amine

Systemtic Name: N-[(6-bromanyl-1,3-benzodioxol-5-yl)methyl]-3-methyl-butan-1-amine Openeye Name: N-[(6-bromo-1,3-benzodioxol-5-yl)methyl]-3-methyl-butan-1-amine CAS Name: N-[(6-bromo-1,3-benzodioxol-5-yl)methyl]-3-methyl-1-butanamine IUPAC Name: N-[(6-bromo-1,3-benzodioxol-5-yl)methyl]-3-methylbutan-1-amine Traditional Name: (6-bromo-1,3-benzodioxol-5-yl)methyl-isoamyl-amine Formula: C13H18BrNO2 MolecularWeight: 300.19152

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNCC1=CC2=C(C=C1Br)OCO2

Isomeric SMILES

CC(C)CCNCC1=CC2=C(C=C1Br)OCO2

InChI

InChI=1S/C13H18BrNO2/c1-9(2)3-4-15-7-10-5-12-13(6-11(10)14)17-8-16-12/h5-6,9,15H,3-4,7-8H2,1-2H3