ethanedioic acid; 1-(1-phenylethoxy)-3-(propan-2-ylamino)propan-2-ol

Systemtic Name: ethanedioic acid; 1-(1-phenylethoxy)-3-(propan-2-ylamino)propan-2-ol Openeye Name: 1-(isopropylamino)-3-(1-phenylethoxy)propan-2-ol; oxalic acid CAS Name: oxalic acid; 1-(1-phenylethoxy)-3-(propan-2-ylamino)-2-propanol IUPAC Name: oxalic acid; 1-(1-phenylethoxy)-3-(propan-2-ylamino)propan-2-ol Traditional Name: 1-(isopropylamino)-3-(1-phenylethoxy)propan-2-ol; oxalic acid Formula: C16H25NO6 MolecularWeight: 327.3728

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NCC(COC(C)C1=CC=CC=C1)O.C(=O)(C(=O)O)O

Isomeric SMILES

CC(C)NCC(COC(C)C1=CC=CC=C1)O.C(=O)(C(=O)O)O

InChI

InChI=1S/C14H23NO2.C2H2O4/c1-11(2)15-9-14(16)10-17-12(3)13-7-5-4-6-8-13;3-1(4)2(5)6/h4-8,11-12,14-16H,9-10H2,1-3H3;(H,3,4)(H,5,6)