4-ethyl-6-[4-(3-methyl-1H-benzimidazol-3-ium-2-yl)-1,2-dihydropyrazol-3-ylidene]-3-oxidanyl-cyclohexa-2,4-dien-1-one

Systemtic Name: 4-ethyl-6-[4-(3-methyl-1H-benzimidazol-3-ium-2-yl)-1,2-dihydropyrazol-3-ylidene]-3-oxidanyl-cyclohexa-2,4-dien-1-one Openeye Name: 4-ethyl-3-hydroxy-6-[4-(3-methyl-1H-benzimidazol-3-ium-2-yl)-1,2-dihydropyrazol-3-ylidene]cyclohexa-2,4-dien-1-one CAS Name: 4-ethyl-3-hydroxy-6-[4-(3-methyl-1H-benzimidazol-3-ium-2-yl)-1,2-dihydropyrazol-3-ylidene]-1-cyclohexa-2,4-dienone IUPAC Name: 4-ethyl-3-hydroxy-6-[4-(3-methyl-1H-benzimidazol-3-ium-2-yl)-1,2-dihydropyrazol-3-ylidene]cyclohexa-2,4-dien-1-one Traditional Name: 4-ethyl-3-hydroxy-6-[4-(3-methyl-1H-benzimidazol-3-ium-2-yl)-3-pyrazolin-3-ylidene]cyclohexa-2,4-dien-1-one Formula: C19H19N4O2+ MolecularWeight: 335.37976

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C2C(=CNN2)C3=[N+](C4=CC=CC=C4N3)C)C(=O)C=C1O

Isomeric SMILES

CCC1=CC(=C2C(=CNN2)C3=[N+](C4=CC=CC=C4N3)C)C(=O)C=C1O

InChI

InChI=1S/C19H18N4O2/c1-3-11-8-12(17(25)9-16(11)24)18-13(10-20-22-18)19-21-14-6-4-5-7-15(14)23(19)2/h4-10H,3H2,1-2H3,(H3,20,21,22,24,25)/p+1