4-[4-(hydroxymethyl)-2,5-dimethyl-1H-pyrazol-3-ylidene]-1,3-dihydroquinoxalin-4-ium-2-one

Systemtic Name: 4-[4-(hydroxymethyl)-2,5-dimethyl-1H-pyrazol-3-ylidene]-1,3-dihydroquinoxalin-4-ium-2-one Openeye Name: 4-[4-(hydroxymethyl)-2,5-dimethyl-1H-pyrazol-3-ylidene]-1,3-dihydroquinoxalin-4-ium-2-one CAS Name: 4-[4-(hydroxymethyl)-2,5-dimethyl-1H-pyrazol-3-ylidene]-1,3-dihydroquinoxalin-4-ium-2-one IUPAC Name: 4-[4-(hydroxymethyl)-2,5-dimethyl-1H-pyrazol-3-ylidene]-1,3-dihydroquinoxalin-4-ium-2-one Traditional Name: 4-(2,5-dimethyl-4-methylol-3-pyrazolin-3-ylidene)-1,3-dihydroquinoxalin-4-ium-2-one Formula: C14H17N4O2+ MolecularWeight: 273.31038

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=[N+]2CC(=O)NC3=CC=CC=C32)N(N1)C)CO

Isomeric SMILES

CC1=C(C(=[N+]2CC(=O)NC3=CC=CC=C32)N(N1)C)CO

InChI

InChI=1S/C14H16N4O2/c1-9-10(8-19)14(17(2)16-9)18-7-13(20)15-11-5-3-4-6-12(11)18/h3-6,19H,7-8H2,1-2H3,(H,15,20)/p+1