4-(3-azanylpropyl)benzene-1,2-diol; 4-ethylbenzene-1,2-diol; hydrochloride

Systemtic Name: 4-(3-azanylpropyl)benzene-1,2-diol; 4-ethylbenzene-1,2-diol; hydrochloride Openeye Name: 4-(3-aminopropyl)benzene-1,2-diol; 4-ethylbenzene-1,2-diol; hydrochloride CAS Name: 4-(3-aminopropyl)benzene-1,2-diol; 4-ethylbenzene-1,2-diol; hydrochloride IUPAC Name: 4-(3-aminopropyl)benzene-1,2-diol; 4-ethylbenzene-1,2-diol; hydrochloride Traditional Name: 4-(3-aminopropyl)pyrocatechol; 4-ethylpyrocatechol; hydrochloride Formula: C17H24ClNO4 MolecularWeight: 341.82976

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)O)O.C1=CC(=C(C=C1CCCN)O)O.Cl

Isomeric SMILES

CCC1=CC(=C(C=C1)O)O.C1=CC(=C(C=C1CCCN)O)O.Cl

InChI

InChI=1S/C9H13NO2.C8H10O2.ClH/c10-5-1-2-7-3-4-8(11)9(12)6-7;1-2-6-3-4-7(9)8(10)5-6;/h3-4,6,11-12H,1-2,5,10H2;3-5,9-10H,2H2,1H3;1H