2-(1,3-benzodioxol-5-yl)-N-[(4-bromophenyl)methyl]ethanamine

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-N-[(4-bromophenyl)methyl]ethanamine Openeye Name: 2-(1,3-benzodioxol-5-yl)-N-[(4-bromophenyl)methyl]ethanamine CAS Name: 2-(1,3-benzodioxol-5-yl)-N-[(4-bromophenyl)methyl]ethanamine IUPAC Name: 2-(1,3-benzodioxol-5-yl)-N-[(4-bromophenyl)methyl]ethanamine Traditional Name: (4-bromobenzyl)-homopiperonyl-amine Formula: C16H16BrNO2 MolecularWeight: 334.20774

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CCNCC3=CC=C(C=C3)Br

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CCNCC3=CC=C(C=C3)Br

InChI

InChI=1S/C16H16BrNO2/c17-14-4-1-13(2-5-14)10-18-8-7-12-3-6-15-16(9-12)20-11-19-15/h1-6,9,18H,7-8,10-11H2