7-(1-azanyl-2-methyl-propan-2-yl)-1-methyl-naphthalene-2,3-diol; ethanoic acid; hydrochloride

Systemtic Name: 7-(1-azanyl-2-methyl-propan-2-yl)-1-methyl-naphthalene-2,3-diol; ethanoic acid; hydrochloride Openeye Name: acetic acid; 7-(2-amino-1,1-dimethyl-ethyl)-1-methyl-naphthalene-2,3-diol; hydrochloride CAS Name: acetic acid; 7-(1-amino-2-methylpropan-2-yl)-1-methylnaphthalene-2,3-diol; hydrochloride IUPAC Name: acetic acid; 7-(1-amino-2-methylpropan-2-yl)-1-methylnaphthalene-2,3-diol; hydrochloride Traditional Name: acetic acid; 7-(2-amino-1,1-dimethyl-ethyl)-1-methyl-naphthalene-2,3-diol; hydrochloride Formula: C19H28ClNO6 MolecularWeight: 401.88172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=C(C=CC2=CC(=C1O)O)C(C)(C)CN.CC(=O)O.CC(=O)O.Cl

Isomeric SMILES

CC1=C2C=C(C=CC2=CC(=C1O)O)C(C)(C)CN.CC(=O)O.CC(=O)O.Cl

InChI

InChI=1S/C15H19NO2.2C2H4O2.ClH/c1-9-12-7-11(15(2,3)8-16)5-4-10(12)6-13(17)14(9)18;2*1-2(3)4;/h4-7,17-18H,8,16H2,1-3H3;2*1H3,(H,3,4);1H