2-azanyl-3-(4-hydroxyphenyl)-5-methyl-4-oxidanylidene-hexanoic acid hydrochloride

Systemtic Name: 2-azanyl-3-(4-hydroxyphenyl)-5-methyl-4-oxidanylidene-hexanoic acid hydrochloride Openeye Name: 2-amino-3-(4-hydroxyphenyl)-5-methyl-4-oxo-hexanoic acid hydrochloride CAS Name: 2-amino-3-(4-hydroxyphenyl)-5-methyl-4-oxohexanoic acid hydrochloride IUPAC Name: 2-amino-3-(4-hydroxyphenyl)-5-methyl-4-oxohexanoic acid hydrochloride Traditional Name: 2-amino-3-(4-hydroxyphenyl)-4-keto-5-methyl-hexanoic acid hydrochloride Formula: C13H18ClNO4 MolecularWeight: 287.73932

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)C(C1=CC=C(C=C1)O)C(C(=O)O)N.Cl

Isomeric SMILES

CC(C)C(=O)C(C1=CC=C(C=C1)O)C(C(=O)O)N.Cl

InChI

InChI=1S/C13H17NO4.ClH/c1-7(2)12(16)10(11(14)13(17)18)8-3-5-9(15)6-4-8;/h3-7,10-11,15H,14H2,1-2H3,(H,17,18);1H