2-oxidanylidene-4-[4-(phenylcarbonyl)pyridin-1-ium-1-yl]-3H-1,3-thiazole-5-carbaldehyde

Systemtic Name: 2-oxidanylidene-4-[4-(phenylcarbonyl)pyridin-1-ium-1-yl]-3H-1,3-thiazole-5-carbaldehyde Openeye Name: 4-(4-benzoylpyridin-1-ium-1-yl)-2-oxo-3H-thiazole-5-carbaldehyde CAS Name: 4-(4-benzoyl-1-pyridin-1-iumyl)-2-oxo-3H-thiazole-5-carboxaldehyde IUPAC Name: 4-(4-benzoylpyridin-1-ium-1-yl)-2-oxo-3H-1,3-thiazole-5-carbaldehyde Traditional Name: 4-(4-benzoylpyridin-1-ium-1-yl)-2-keto-4-thiazoline-5-carbaldehyde Formula: C16H11N2O3S+ MolecularWeight: 311.33514

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C2=CC=[N+](C=C2)C3=C(SC(=O)N3)C=O

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C2=CC=[N+](C=C2)C3=C(SC(=O)N3)C=O

InChI

InChI=1S/C16H10N2O3S/c19-10-13-15(17-16(21)22-13)18-8-6-12(7-9-18)14(20)11-4-2-1-3-5-11/h1-10H/p+1