ethanedioic acid; 1-(4-methylpiperidin-1-yl)-3-(2-propan-2-ylphenoxy)propan-2-ol

Systemtic Name: ethanedioic acid; 1-(4-methylpiperidin-1-yl)-3-(2-propan-2-ylphenoxy)propan-2-ol Openeye Name: 1-(2-isopropylphenoxy)-3-(4-methyl-1-piperidyl)propan-2-ol; oxalic acid CAS Name: 1-(4-methyl-1-piperidinyl)-3-(2-propan-2-ylphenoxy)-2-propanol; oxalic acid IUPAC Name: 1-(4-methylpiperidin-1-yl)-3-(2-propan-2-ylphenoxy)propan-2-ol; oxalic acid Traditional Name: 1-(2-isopropylphenoxy)-3-(4-methylpiperidino)propan-2-ol; oxalic acid Formula: C20H31NO6 MolecularWeight: 381.46324

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)CC(COC2=CC=CC=C2C(C)C)O.C(=O)(C(=O)O)O

Isomeric SMILES

CC1CCN(CC1)CC(COC2=CC=CC=C2C(C)C)O.C(=O)(C(=O)O)O

InChI

InChI=1S/C18H29NO2.C2H2O4/c1-14(2)17-6-4-5-7-18(17)21-13-16(20)12-19-10-8-15(3)9-11-19;3-1(4)2(5)6/h4-7,14-16,20H,8-13H2,1-3H3;(H,3,4)(H,5,6)