N-[(7-bromanyl-1,3-benzodioxol-5-yl)methyl]pentan-2-amine

Systemtic Name: N-[(7-bromanyl-1,3-benzodioxol-5-yl)methyl]pentan-2-amine Openeye Name: N-[(7-bromo-1,3-benzodioxol-5-yl)methyl]pentan-2-amine CAS Name: N-[(7-bromo-1,3-benzodioxol-5-yl)methyl]-2-pentanamine IUPAC Name: N-[(7-bromo-1,3-benzodioxol-5-yl)methyl]pentan-2-amine Traditional Name: (7-bromo-1,3-benzodioxol-5-yl)methyl-(1-methylbutyl)amine Formula: C13H18BrNO2 MolecularWeight: 300.19152

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)NCC1=CC2=C(C(=C1)Br)OCO2

Isomeric SMILES

CCCC(C)NCC1=CC2=C(C(=C1)Br)OCO2

InChI

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