(Z)-[5-(4-methylpyridin-1-ium-1-yl)-2-oxidanylidene-3-phenyl-imidazol-4-ylidene]methanolate

Systemtic Name: (Z)-[5-(4-methylpyridin-1-ium-1-yl)-2-oxidanylidene-3-phenyl-imidazol-4-ylidene]methanolate Openeye Name: (Z)-[5-(4-methylpyridin-1-ium-1-yl)-2-oxo-3-phenyl-imidazol-4-ylidene]methanolate CAS Name: (Z)-[5-(4-methyl-1-pyridin-1-iumyl)-2-oxo-3-phenyl-4-imidazolylidene]methanolate IUPAC Name: (Z)-[5-(4-methylpyridin-1-ium-1-yl)-2-oxo-3-phenylimidazol-4-ylidene]methanolate Traditional Name: (Z)-[2-keto-5-(4-methylpyridin-1-ium-1-yl)-3-phenyl-3-imidazolin-4-ylidene]methanolate Formula: C16H13N3O2 MolecularWeight: 279.29332

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=[N+](C=C1)C2=NC(=O)N(C2=C[O-])C3=CC=CC=C3

Isomeric SMILES

CC1=CC=[N+](C=C1)C\2=NC(=O)N(/C2=C\[O-])C3=CC=CC=C3

InChI

InChI=1S/C16H13N3O2/c1-12-7-9-18(10-8-12)15-14(11-20)19(16(21)17-15)13-5-3-2-4-6-13/h2-11H,1H3