3-bromanyl-N-[(2,3,4-trimethoxyphenyl)methyl]aniline

Systemtic Name: 3-bromanyl-N-[(2,3,4-trimethoxyphenyl)methyl]aniline Openeye Name: 3-bromo-N-[(2,3,4-trimethoxyphenyl)methyl]aniline CAS Name: 3-bromo-N-[(2,3,4-trimethoxyphenyl)methyl]aniline IUPAC Name: 3-bromo-N-[(2,3,4-trimethoxyphenyl)methyl]aniline Traditional Name: (3-bromophenyl)-(2,3,4-trimethoxybenzyl)amine Formula: C16H18BrNO3 MolecularWeight: 352.22302

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)CNC2=CC(=CC=C2)Br)OC)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)CNC2=CC(=CC=C2)Br)OC)OC

InChI

InChI=1S/C16H18BrNO3/c1-19-14-8-7-11(15(20-2)16(14)21-3)10-18-13-6-4-5-12(17)9-13/h4-9,18H,10H2,1-3H3