1-[3,4-bis(oxidanyl)phenyl]-2-(propan-2-ylamino)ethanone chloride

Systemtic Name: 1-[3,4-bis(oxidanyl)phenyl]-2-(propan-2-ylamino)ethanone chloride Openeye Name: 1-(3,4-dihydroxyphenyl)-2-(isopropylamino)ethanone chloride CAS Name: 1-(3,4-dihydroxyphenyl)-2-(propan-2-ylamino)ethanone chloride IUPAC Name: 1-(3,4-dihydroxyphenyl)-2-(propan-2-ylamino)ethanone chloride Traditional Name: 1-(3,4-dihydroxyphenyl)-2-(isopropylamino)ethanone chloride Formula: C11H15ClNO3- MolecularWeight: 244.6947

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H15NO3.ClH/c1-7(2)12-6-11(15)8-3-4-9(13)10(14)5-8;/h3-5,7,12-14H,6H2,1-2H3;1H/p-1