N-[1-(1,3-benzodioxol-5-yl)ethyl]-1-(3-bromophenyl)ethanamine

Systemtic Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-1-(3-bromophenyl)ethanamine Openeye Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-1-(3-bromophenyl)ethanamine CAS Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-1-(3-bromophenyl)ethanamine IUPAC Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-1-(3-bromophenyl)ethanamine Traditional Name: 1-(1,3-benzodioxol-5-yl)ethyl-[1-(3-bromophenyl)ethyl]amine Formula: C17H18BrNO2 MolecularWeight: 348.23432

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC=C1)Br)NC(C)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC(C1=CC(=CC=C1)Br)NC(C)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C17H18BrNO2/c1-11(13-4-3-5-15(18)8-13)19-12(2)14-6-7-16-17(9-14)21-10-20-16/h3-9,11-12,19H,10H2,1-2H3