(7-bromanyl-1,3-benzodioxol-5-yl)methyl-[(4-methoxyphenyl)methyl]azanium

Systemtic Name: (7-bromanyl-1,3-benzodioxol-5-yl)methyl-[(4-methoxyphenyl)methyl]azanium Openeye Name: (7-bromo-1,3-benzodioxol-5-yl)methyl-[(4-methoxyphenyl)methyl]ammonium CAS Name: (7-bromo-1,3-benzodioxol-5-yl)methyl-[(4-methoxyphenyl)methyl]ammonium IUPAC Name: (7-bromo-1,3-benzodioxol-5-yl)methyl-[(4-methoxyphenyl)methyl]azanium Traditional Name: (7-bromo-1,3-benzodioxol-5-yl)methyl-p-anisyl-ammonium Formula: C16H17BrNO3+ MolecularWeight: 351.21508

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C[NH2+]CC2=CC3=C(C(=C2)Br)OCO3

Isomeric SMILES

COC1=CC=C(C=C1)C[NH2+]CC2=CC3=C(C(=C2)Br)OCO3

InChI

InChI=1S/C16H16BrNO3/c1-19-13-4-2-11(3-5-13)8-18-9-12-6-14(17)16-15(7-12)20-10-21-16/h2-7,18H,8-10H2,1H3/p+1