(1E,3E)-2-methyl-4-[2-(4-nitrophenyl)carbonylhydrazinyl]penta-1,3-diene-1-sulfonic acid

Systemtic Name: (1E,3E)-2-methyl-4-[2-(4-nitrophenyl)carbonylhydrazinyl]penta-1,3-diene-1-sulfonic acid Openeye Name: (1E,3E)-2-methyl-4-[2-(4-nitrobenzoyl)hydrazino]penta-1,3-diene-1-sulfonic acid CAS Name: (1E,3E)-2-methyl-4-[[(4-nitrophenyl)-oxomethyl]hydrazo]-1-penta-1,3-dienesulfonic acid IUPAC Name: (1E,3E)-2-methyl-4-[2-(4-nitrobenzoyl)hydrazinyl]penta-1,3-diene-1-sulfonic acid Traditional Name: (1E,3E)-2-methyl-4-[N'-(4-nitrobenzoyl)hydrazino]penta-1,3-diene-1-sulfonic acid Formula: C13H15N3O6S MolecularWeight: 341.3397

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=CS(=O)(=O)O)C)NNC(=O)C1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

C/C(=C\C(=C\S(=O)(=O)O)\C)/NNC(=O)C1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C13H15N3O6S/c1-9(8-23(20,21)22)7-10(2)14-15-13(17)11-3-5-12(6-4-11)16(18)19/h3-8,14H,1-2H3,(H,15,17)(H,20,21,22)/b9-8+,10-7+