4-(2-azanylpropyl)naphthalene-1,5-diol; ethanoic acid; hydrochloride

Systemtic Name: 4-(2-azanylpropyl)naphthalene-1,5-diol; ethanoic acid; hydrochloride Openeye Name: acetic acid; 4-(2-aminopropyl)naphthalene-1,5-diol; hydrochloride CAS Name: acetic acid; 4-(2-aminopropyl)naphthalene-1,5-diol; hydrochloride IUPAC Name: acetic acid; 4-(2-aminopropyl)naphthalene-1,5-diol; hydrochloride Traditional Name: acetic acid; 4-(2-aminopropyl)naphthalene-1,5-diol; hydrochloride Formula: C17H24ClNO6 MolecularWeight: 373.82856

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=C2C(=C(C=C1)O)C=CC=C2O)N.CC(=O)O.CC(=O)O.Cl

Isomeric SMILES

CC(CC1=C2C(=C(C=C1)O)C=CC=C2O)N.CC(=O)O.CC(=O)O.Cl

InChI

InChI=1S/C13H15NO2.2C2H4O2.ClH/c1-8(14)7-9-5-6-11(15)10-3-2-4-12(16)13(9)10;2*1-2(3)4;/h2-6,8,15-16H,7,14H2,1H3;2*1H3,(H,3,4);1H