(1E,3E)-2-methyl-4-(2-pyridin-4-ylcarbonylhydrazinyl)penta-1,3-diene-1-sulfonic acid

Systemtic Name: (1E,3E)-2-methyl-4-(2-pyridin-4-ylcarbonylhydrazinyl)penta-1,3-diene-1-sulfonic acid Openeye Name: (1E,3E)-2-methyl-4-[2-(pyridine-4-carbonyl)hydrazino]penta-1,3-diene-1-sulfonic acid CAS Name: (1E,3E)-2-methyl-4-[[oxo(pyridin-4-yl)methyl]hydrazo]-1-penta-1,3-dienesulfonic acid IUPAC Name: (1E,3E)-2-methyl-4-[2-(pyridine-4-carbonyl)hydrazinyl]penta-1,3-diene-1-sulfonic acid Traditional Name: (1E,3E)-4-(N'-isonicotinoylhydrazino)-2-methyl-penta-1,3-diene-1-sulfonic acid Formula: C12H15N3O4S MolecularWeight: 297.3302

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=CS(=O)(=O)O)C)NNC(=O)C1=CC=NC=C1

Isomeric SMILES

C/C(=C\C(=C\S(=O)(=O)O)\C)/NNC(=O)C1=CC=NC=C1

InChI

InChI=1S/C12H15N3O4S/c1-9(8-20(17,18)19)7-10(2)14-15-12(16)11-3-5-13-6-4-11/h3-8,14H,1-2H3,(H,15,16)(H,17,18,19)/b9-8+,10-7+