2-ethyl-2-methyl-hexanoic acid; pyridin-2-ylmethanol; hydrochloride

Systemtic Name: 2-ethyl-2-methyl-hexanoic acid; pyridin-2-ylmethanol; hydrochloride Openeye Name: 2-ethyl-2-methyl-hexanoic acid; 2-pyridylmethanol; hydrochloride CAS Name: 2-ethyl-2-methylhexanoic acid; 2-pyridinylmethanol; hydrochloride IUPAC Name: 2-ethyl-2-methylhexanoic acid; pyridin-2-ylmethanol; hydrochloride Traditional Name: 2-ethyl-2-methyl-hexanoic acid; 2-pyridylmethanol; hydrochloride Formula: C15H26ClNO3 MolecularWeight: 303.82484

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)(CC)C(=O)O.C1=CC=NC(=C1)CO.Cl

Isomeric SMILES

CCCCC(C)(CC)C(=O)O.C1=CC=NC(=C1)CO.Cl

InChI

InChI=1S/C9H18O2.C6H7NO.ClH/c1-4-6-7-9(3,5-2)8(10)11;8-5-6-3-1-2-4-7-6;/h4-7H2,1-3H3,(H,10,11);1-4,8H,5H2;1H