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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNCC1=CC2=C(C=C1Br)OCO2

Isomeric SMILES

CCCCCNCC1=CC2=C(C=C1Br)OCO2

InChI

InChI=1S/C13H18BrNO2/c1-2-3-4-5-15-8-10-6-12-13(7-11(10)14)17-9-16-12/h6-7,15H,2-5,8-9H2,1H3