ethanedioic acid; 2-(3-methoxy-4-phenylmethoxy-phenyl)ethanamine

Systemtic Name: ethanedioic acid; 2-(3-methoxy-4-phenylmethoxy-phenyl)ethanamine Openeye Name: 2-(4-benzyloxy-3-methoxy-phenyl)ethanamine; oxalic acid CAS Name: 2-(3-methoxy-4-phenylmethoxyphenyl)ethanamine; oxalic acid IUPAC Name: 2-(3-methoxy-4-phenylmethoxyphenyl)ethanamine; oxalic acid Traditional Name: 2-(4-benzoxy-3-methoxy-phenyl)ethylamine; oxalic acid Formula: C18H21NO6 MolecularWeight: 347.36244

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CCN)OCC2=CC=CC=C2.C(=O)(C(=O)O)O

Isomeric SMILES

COC1=C(C=CC(=C1)CCN)OCC2=CC=CC=C2.C(=O)(C(=O)O)O

InChI

InChI=1S/C16H19NO2.C2H2O4/c1-18-16-11-13(9-10-17)7-8-15(16)19-12-14-5-3-2-4-6-14;3-1(4)2(5)6/h2-8,11H,9-10,12,17H2,1H3;(H,3,4)(H,5,6)