N-[(3-bromophenyl)methyl]-2-(2-methoxyphenyl)ethanamine; ethanedioic acid

Systemtic Name: N-[(3-bromophenyl)methyl]-2-(2-methoxyphenyl)ethanamine; ethanedioic acid Openeye Name: N-[(3-bromophenyl)methyl]-2-(2-methoxyphenyl)ethanamine; oxalic acid CAS Name: N-[(3-bromophenyl)methyl]-2-(2-methoxyphenyl)ethanamine; oxalic acid IUPAC Name: N-[(3-bromophenyl)methyl]-2-(2-methoxyphenyl)ethanamine; oxalic acid Traditional Name: (3-bromobenzyl)-[2-(2-methoxyphenyl)ethyl]amine; oxalic acid Formula: C18H20BrNO5 MolecularWeight: 410.2591

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CCNCC2=CC(=CC=C2)Br.C(=O)(C(=O)O)O

Isomeric SMILES

COC1=CC=CC=C1CCNCC2=CC(=CC=C2)Br.C(=O)(C(=O)O)O

InChI

InChI=1S/C16H18BrNO.C2H2O4/c1-19-16-8-3-2-6-14(16)9-10-18-12-13-5-4-7-15(17)11-13;3-1(4)2(5)6/h2-8,11,18H,9-10,12H2,1H3;(H,3,4)(H,5,6)