(E)-(1-oxidanyl-1-oxidanylidene-propan-2-ylidene)-(quinolin-8-ylamino)azanium chloride

Systemtic Name: (E)-(1-oxidanyl-1-oxidanylidene-propan-2-ylidene)-(quinolin-8-ylamino)azanium chloride Openeye Name: (E)-(2-hydroxy-1-methyl-2-oxo-ethylidene)-(8-quinolylamino)ammonium chloride CAS Name: (E)-(1-hydroxy-1-oxopropan-2-ylidene)-(8-quinolinylamino)ammonium chloride IUPAC Name: (E)-(1-hydroxy-1-oxopropan-2-ylidene)-(quinolin-8-ylamino)azanium chloride Traditional Name: (E)-(2-hydroxy-2-keto-1-methyl-ethylidene)-(8-quinolylamino)ammonium chloride Formula: C12H12ClN3O2 MolecularWeight: 265.69558

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Descriptors Computed from Structure

Canonical SMILES:

CC(=[NH+]NC1=CC=CC2=C1N=CC=C2)C(=O)O.[Cl-]

Isomeric SMILES

C/C(=[NH+]\NC1=CC=CC2=C1N=CC=C2)/C(=O)O.[Cl-]

InChI

InChI=1S/C12H11N3O2.ClH/c1-8(12(16)17)14-15-10-6-2-4-9-5-3-7-13-11(9)10;/h2-7,15H,1H3,(H,16,17);1H/b14-8+;