N-[(6-bromanyl-1,3-benzodioxol-5-yl)methyl]-1-(3-methylphenyl)methanamine

Systemtic Name: N-[(6-bromanyl-1,3-benzodioxol-5-yl)methyl]-1-(3-methylphenyl)methanamine Openeye Name: N-[(6-bromo-1,3-benzodioxol-5-yl)methyl]-1-(m-tolyl)methanamine CAS Name: N-[(6-bromo-1,3-benzodioxol-5-yl)methyl]-1-(3-methylphenyl)methanamine IUPAC Name: N-[(6-bromo-1,3-benzodioxol-5-yl)methyl]-1-(3-methylphenyl)methanamine Traditional Name: (6-bromo-1,3-benzodioxol-5-yl)methyl-(3-methylbenzyl)amine Formula: C16H16BrNO2 MolecularWeight: 334.20774

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CNCC2=CC3=C(C=C2Br)OCO3

Isomeric SMILES

CC1=CC(=CC=C1)CNCC2=CC3=C(C=C2Br)OCO3

InChI

InChI=1S/C16H16BrNO2/c1-11-3-2-4-12(5-11)8-18-9-13-6-15-16(7-14(13)17)20-10-19-15/h2-7,18H,8-10H2,1H3