3-pentadecyl-4-(piperidin-1-ylmethyl)benzene-1,2-diol hydrochloride

Systemtic Name: 3-pentadecyl-4-(piperidin-1-ylmethyl)benzene-1,2-diol hydrochloride Openeye Name: 3-pentadecyl-4-(1-piperidylmethyl)benzene-1,2-diol hydrochloride CAS Name: 3-pentadecyl-4-(1-piperidinylmethyl)benzene-1,2-diol hydrochloride IUPAC Name: 3-pentadecyl-4-(piperidin-1-ylmethyl)benzene-1,2-diol hydrochloride Traditional Name: 3-pentadecyl-4-(piperidinomethyl)pyrocatechol hydrochloride Formula: C27H48ClNO2 MolecularWeight: 454.12852

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC1=C(C=CC(=C1O)O)CN2CCCCC2.Cl

Isomeric SMILES

CCCCCCCCCCCCCCCC1=C(C=CC(=C1O)O)CN2CCCCC2.Cl

InChI

InChI=1S/C27H47NO2.ClH/c1-2-3-4-5-6-7-8-9-10-11-12-13-15-18-25-24(19-20-26(29)27(25)30)23-28-21-16-14-17-22-28;/h19-20,29-30H,2-18,21-23H2,1H3;1H