2-(3,4-dimethoxyphenyl)-N-(1H-indol-3-ylmethyl)ethanamine; ethanedioic acid

Systemtic Name: 2-(3,4-dimethoxyphenyl)-N-(1H-indol-3-ylmethyl)ethanamine; ethanedioic acid Openeye Name: 2-(3,4-dimethoxyphenyl)-N-(1H-indol-3-ylmethyl)ethanamine; oxalic acid CAS Name: 2-(3,4-dimethoxyphenyl)-N-(1H-indol-3-ylmethyl)ethanamine; oxalic acid IUPAC Name: 2-(3,4-dimethoxyphenyl)-N-(1H-indol-3-ylmethyl)ethanamine; oxalic acid Traditional Name: homoveratryl(1H-indol-3-ylmethyl)amine; oxalic acid Formula: C21H24N2O6 MolecularWeight: 400.42506

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNCC2=CNC3=CC=CC=C32)OC.C(=O)(C(=O)O)O

Isomeric SMILES

COC1=C(C=C(C=C1)CCNCC2=CNC3=CC=CC=C32)OC.C(=O)(C(=O)O)O

InChI

InChI=1S/C19H22N2O2.C2H2O4/c1-22-18-8-7-14(11-19(18)23-2)9-10-20-12-15-13-21-17-6-4-3-5-16(15)17;3-1(4)2(5)6/h3-8,11,13,20-21H,9-10,12H2,1-2H3;(H,3,4)(H,5,6)