ethanedioic acid; 1-[3-(2-methylphenoxy)propylamino]propan-2-ol

Systemtic Name: ethanedioic acid; 1-[3-(2-methylphenoxy)propylamino]propan-2-ol Openeye Name: 1-[3-(2-methylphenoxy)propylamino]propan-2-ol; oxalic acid CAS Name: 1-[3-(2-methylphenoxy)propylamino]-2-propanol; oxalic acid IUPAC Name: 1-[3-(2-methylphenoxy)propylamino]propan-2-ol; oxalic acid Traditional Name: 1-[3-(2-methylphenoxy)propylamino]propan-2-ol; oxalic acid Formula: C15H23NO6 MolecularWeight: 313.34622

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OCCCNCC(C)O.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=CC=CC=C1OCCCNCC(C)O.C(=O)(C(=O)O)O

InChI

InChI=1S/C13H21NO2.C2H2O4/c1-11-6-3-4-7-13(11)16-9-5-8-14-10-12(2)15;3-1(4)2(5)6/h3-4,6-7,12,14-15H,5,8-10H2,1-2H3;(H,3,4)(H,5,6)