ethanedioic acid; 1-(ethylamino)-3-(2,3,6-trimethylphenoxy)propan-2-ol

Systemtic Name: ethanedioic acid; 1-(ethylamino)-3-(2,3,6-trimethylphenoxy)propan-2-ol Openeye Name: 1-(ethylamino)-3-(2,3,6-trimethylphenoxy)propan-2-ol; oxalic acid CAS Name: 1-(ethylamino)-3-(2,3,6-trimethylphenoxy)-2-propanol; oxalic acid IUPAC Name: 1-(ethylamino)-3-(2,3,6-trimethylphenoxy)propan-2-ol; oxalic acid Traditional Name: 1-(ethylamino)-3-(2,3,6-trimethylphenoxy)propan-2-ol; oxalic acid Formula: C16H25NO6 MolecularWeight: 327.3728

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Descriptors Computed from Structure

Canonical SMILES:

CCNCC(COC1=C(C=CC(=C1C)C)C)O.C(=O)(C(=O)O)O

Isomeric SMILES

CCNCC(COC1=C(C=CC(=C1C)C)C)O.C(=O)(C(=O)O)O

InChI

InChI=1S/C14H23NO2.C2H2O4/c1-5-15-8-13(16)9-17-14-11(3)7-6-10(2)12(14)4;3-1(4)2(5)6/h6-7,13,15-16H,5,8-9H2,1-4H3;(H,3,4)(H,5,6)