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

Systemtic Name: 3-(3-azanylpropyl)phenol; 4-ethylbenzene-1,2-diol; hydrochloride Openeye Name: 3-(3-aminopropyl)phenol; 4-ethylbenzene-1,2-diol; hydrochloride CAS Name: 3-(3-aminopropyl)phenol; 4-ethylbenzene-1,2-diol; hydrochloride IUPAC Name: 3-(3-aminopropyl)phenol; 4-ethylbenzene-1,2-diol; hydrochloride Traditional Name: 3-(3-aminopropyl)phenol; 4-ethylpyrocatechol; hydrochloride Formula: C17H24ClNO3 MolecularWeight: 325.83036

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H13NO.C8H10O2.ClH/c10-6-2-4-8-3-1-5-9(11)7-8;1-2-6-3-4-7(9)8(10)5-6;/h1,3,5,7,11H,2,4,6,10H2;3-5,9-10H,2H2,1H3;1H