3-piperidin-1-ylpropan-1-ol; 3,4,5-trimethoxybenzoic acid; hydrochloride

Systemtic Name: 3-piperidin-1-ylpropan-1-ol; 3,4,5-trimethoxybenzoic acid; hydrochloride Openeye Name: 3-(1-piperidyl)propan-1-ol; 3,4,5-trimethoxybenzoic acid; hydrochloride CAS Name: 3-(1-piperidinyl)-1-propanol; 3,4,5-trimethoxybenzoic acid; hydrochloride IUPAC Name: 3-piperidin-1-ylpropan-1-ol; 3,4,5-trimethoxybenzoic acid; hydrochloride Traditional Name: 3-piperidinopropan-1-ol; 3,4,5-trimethoxybenzoic acid; hydrochloride Formula: C18H30ClNO6 MolecularWeight: 391.8869

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)O.C1CCN(CC1)CCCO.Cl

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)O.C1CCN(CC1)CCCO.Cl

InChI

InChI=1S/C10H12O5.C8H17NO.ClH/c1-13-7-4-6(10(11)12)5-8(14-2)9(7)15-3;10-8-4-7-9-5-2-1-3-6-9;/h4-5H,1-3H3,(H,11,12);10H,1-8H2;1H