N-[(6-bromanyl-1,3-benzodioxol-5-yl)methyl]-1-phenyl-ethanamine

Systemtic Name: N-[(6-bromanyl-1,3-benzodioxol-5-yl)methyl]-1-phenyl-ethanamine Openeye Name: N-[(6-bromo-1,3-benzodioxol-5-yl)methyl]-1-phenyl-ethanamine CAS Name: N-[(6-bromo-1,3-benzodioxol-5-yl)methyl]-1-phenylethanamine IUPAC Name: N-[(6-bromo-1,3-benzodioxol-5-yl)methyl]-1-phenylethanamine Traditional Name: (6-bromo-1,3-benzodioxol-5-yl)methyl-(1-phenylethyl)amine Formula: C16H16BrNO2 MolecularWeight: 334.20774

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NCC2=CC3=C(C=C2Br)OCO3

Isomeric SMILES

CC(C1=CC=CC=C1)NCC2=CC3=C(C=C2Br)OCO3

InChI

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