[2-[3,4-bis(oxidanyl)phenyl]-2-oxidanylidene-ethyl]-methyl-azanium chloride

Systemtic Name: [2-[3,4-bis(oxidanyl)phenyl]-2-oxidanylidene-ethyl]-methyl-azanium chloride Openeye Name: [2-(3,4-dihydroxyphenyl)-2-oxo-ethyl]-methyl-ammonium chloride CAS Name: [2-(3,4-dihydroxyphenyl)-2-oxoethyl]-methylammonium chloride IUPAC Name: [2-(3,4-dihydroxyphenyl)-2-oxoethyl]-methylazanium chloride Traditional Name: [2-(3,4-dihydroxyphenyl)-2-keto-ethyl]-methyl-ammonium chloride Formula: C9H12ClNO3 MolecularWeight: 217.64948

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH2+]CC(=O)C1=CC(=C(C=C1)O)O.[Cl-]

Isomeric SMILES

C[NH2+]CC(=O)C1=CC(=C(C=C1)O)O.[Cl-]

InChI

InChI=1S/C9H11NO3.ClH/c1-10-5-9(13)6-2-3-7(11)8(12)4-6;/h2-4,10-12H,5H2,1H3;1H