ethanedioic acid; 3-[[methyl(phenethyl)amino]methyl]phenol

Systemtic Name: ethanedioic acid; 3-[[methyl(phenethyl)amino]methyl]phenol Openeye Name: 3-[[methyl(phenethyl)amino]methyl]phenol; oxalic acid CAS Name: 3-[[methyl(phenethyl)amino]methyl]phenol; oxalic acid IUPAC Name: 3-[[methyl(phenethyl)amino]methyl]phenol; oxalic acid Traditional Name: 3-[[methyl(phenethyl)amino]methyl]phenol; oxalic acid Formula: C18H21NO5 MolecularWeight: 331.36304

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC=CC=C1)CC2=CC(=CC=C2)O.C(=O)(C(=O)O)O

Isomeric SMILES

CN(CCC1=CC=CC=C1)CC2=CC(=CC=C2)O.C(=O)(C(=O)O)O

InChI

InChI=1S/C16H19NO.C2H2O4/c1-17(11-10-14-6-3-2-4-7-14)13-15-8-5-9-16(18)12-15;3-1(4)2(5)6/h2-9,12,18H,10-11,13H2,1H3;(H,3,4)(H,5,6)