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

Systemtic Name: [2-[3,4-bis(oxidanyl)phenyl]-2-oxidanylidene-ethyl]-cyclopentyl-azanium chloride Openeye Name: cyclopentyl-[2-(3,4-dihydroxyphenyl)-2-oxo-ethyl]ammonium chloride CAS Name: cyclopentyl-[2-(3,4-dihydroxyphenyl)-2-oxoethyl]ammonium chloride IUPAC Name: cyclopentyl-[2-(3,4-dihydroxyphenyl)-2-oxoethyl]azanium chloride Traditional Name: cyclopentyl-[2-(3,4-dihydroxyphenyl)-2-keto-ethyl]ammonium chloride Formula: C13H18ClNO3 MolecularWeight: 271.73992

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)[NH2+]CC(=O)C2=CC(=C(C=C2)O)O.[Cl-]

Isomeric SMILES

C1CCC(C1)[NH2+]CC(=O)C2=CC(=C(C=C2)O)O.[Cl-]

InChI

InChI=1S/C13H17NO3.ClH/c15-11-6-5-9(7-12(11)16)13(17)8-14-10-3-1-2-4-10;/h5-7,10,14-16H,1-4,8H2;1H