4-[[2-(4-chlorophenyl)ethylamino]methyl]-2,6-dimethoxy-phenol; ethanedioic acid

Systemtic Name: 4-[[2-(4-chlorophenyl)ethylamino]methyl]-2,6-dimethoxy-phenol; ethanedioic acid Openeye Name: 4-[[2-(4-chlorophenyl)ethylamino]methyl]-2,6-dimethoxy-phenol; oxalic acid CAS Name: 4-[[2-(4-chlorophenyl)ethylamino]methyl]-2,6-dimethoxyphenol; oxalic acid IUPAC Name: 4-[[2-(4-chlorophenyl)ethylamino]methyl]-2,6-dimethoxyphenol; oxalic acid Traditional Name: 4-[[2-(4-chlorophenyl)ethylamino]methyl]-2,6-dimethoxy-phenol; oxalic acid Formula: C19H22ClNO7 MolecularWeight: 411.83348

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1O)OC)CNCCC2=CC=C(C=C2)Cl.C(=O)(C(=O)O)O

Isomeric SMILES

COC1=CC(=CC(=C1O)OC)CNCCC2=CC=C(C=C2)Cl.C(=O)(C(=O)O)O

InChI

InChI=1S/C17H20ClNO3.C2H2O4/c1-21-15-9-13(10-16(22-2)17(15)20)11-19-8-7-12-3-5-14(18)6-4-12;3-1(4)2(5)6/h3-6,9-10,19-20H,7-8,11H2,1-2H3;(H,3,4)(H,5,6)