ethanedioic acid; 4-[[2-(1H-indol-3-yl)ethylamino]methyl]-2,6-dimethoxy-phenol

Systemtic Name: ethanedioic acid; 4-[[2-(1H-indol-3-yl)ethylamino]methyl]-2,6-dimethoxy-phenol Openeye Name: 4-[[2-(1H-indol-3-yl)ethylamino]methyl]-2,6-dimethoxy-phenol; oxalic acid CAS Name: 4-[[2-(1H-indol-3-yl)ethylamino]methyl]-2,6-dimethoxyphenol; oxalic acid IUPAC Name: 4-[[2-(1H-indol-3-yl)ethylamino]methyl]-2,6-dimethoxyphenol; oxalic acid Traditional Name: 4-[[2-(1H-indol-3-yl)ethylamino]methyl]-2,6-dimethoxy-phenol; oxalic acid Formula: C21H24N2O7 MolecularWeight: 416.42446

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1O)OC)CNCCC2=CNC3=CC=CC=C32.C(=O)(C(=O)O)O

Isomeric SMILES

COC1=CC(=CC(=C1O)OC)CNCCC2=CNC3=CC=CC=C32.C(=O)(C(=O)O)O

InChI

InChI=1S/C19H22N2O3.C2H2O4/c1-23-17-9-13(10-18(24-2)19(17)22)11-20-8-7-14-12-21-16-6-4-3-5-15(14)16;3-1(4)2(5)6/h3-6,9-10,12,20-22H,7-8,11H2,1-2H3;(H,3,4)(H,5,6)