6-(2-piperidin-1-ylethyl)naphthalene-2,3-diol; propanoic acid; hydrochloride

Systemtic Name: 6-(2-piperidin-1-ylethyl)naphthalene-2,3-diol; propanoic acid; hydrochloride Openeye Name: 6-[2-(1-piperidyl)ethyl]naphthalene-2,3-diol; propionic acid; hydrochloride CAS Name: 6-[2-(1-piperidinyl)ethyl]naphthalene-2,3-diol; propanoic acid; hydrochloride IUPAC Name: 6-(2-piperidin-1-ylethyl)naphthalene-2,3-diol; propanoic acid; hydrochloride Traditional Name: 6-(2-piperidinoethyl)naphthalene-2,3-diol; propionic acid; hydrochloride Formula: C23H34ClNO6 MolecularWeight: 455.97216

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)O.CCC(=O)O.C1CCN(CC1)CCC2=CC3=CC(=C(C=C3C=C2)O)O.Cl

Isomeric SMILES

CCC(=O)O.CCC(=O)O.C1CCN(CC1)CCC2=CC3=CC(=C(C=C3C=C2)O)O.Cl

InChI

InChI=1S/C17H21NO2.2C3H6O2.ClH/c19-16-11-14-5-4-13(10-15(14)12-17(16)20)6-9-18-7-2-1-3-8-18;2*1-2-3(4)5;/h4-5,10-12,19-20H,1-3,6-9H2;2*2H2,1H3,(H,4,5);1H