1-methylpiperidin-4-ol; 3,4,5-trimethoxybenzoic acid; hydrochloride

Systemtic Name: 1-methylpiperidin-4-ol; 3,4,5-trimethoxybenzoic acid; hydrochloride Openeye Name: 1-methylpiperidin-4-ol; 3,4,5-trimethoxybenzoic acid; hydrochloride CAS Name: 1-methyl-4-piperidinol; 3,4,5-trimethoxybenzoic acid; hydrochloride IUPAC Name: 1-methylpiperidin-4-ol; 3,4,5-trimethoxybenzoic acid; hydrochloride Traditional Name: 1-methylpiperidin-4-ol; 3,4,5-trimethoxybenzoic acid; hydrochloride Formula: C16H26ClNO6 MolecularWeight: 363.83374

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1)O.COC1=CC(=CC(=C1OC)OC)C(=O)O.Cl

Isomeric SMILES

CN1CCC(CC1)O.COC1=CC(=CC(=C1OC)OC)C(=O)O.Cl

InChI

InChI=1S/C10H12O5.C6H13NO.ClH/c1-13-7-4-6(10(11)12)5-8(14-2)9(7)15-3;1-7-4-2-6(8)3-5-7;/h4-5H,1-3H3,(H,11,12);6,8H,2-5H2,1H3;1H