5-[2-(4-azanylidene-6-methyl-3-oxidanylidene-cyclohexa-1,5-dien-1-yl)hydrazinyl]-2-chloranyl-benzenesulfonic acid

Systemtic Name: 5-[2-(4-azanylidene-6-methyl-3-oxidanylidene-cyclohexa-1,5-dien-1-yl)hydrazinyl]-2-chloranyl-benzenesulfonic acid Openeye Name: 2-chloro-5-[2-(4-imino-6-methyl-3-oxo-cyclohexa-1,5-dien-1-yl)hydrazino]benzenesulfonic acid CAS Name: 2-chloro-5-[(4-imino-6-methyl-3-oxo-1-cyclohexa-1,5-dienyl)hydrazo]benzenesulfonic acid IUPAC Name: 2-chloro-5-[2-(4-imino-6-methyl-3-oxocyclohexa-1,5-dien-1-yl)hydrazinyl]benzenesulfonic acid Traditional Name: 2-chloro-5-[N'-(4-imino-3-keto-6-methyl-cyclohexa-1,5-dien-1-yl)hydrazino]besylic acid Formula: C13H12ClN3O4S MolecularWeight: 341.77008

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=N)C(=O)C=C1NNC2=CC(=C(C=C2)Cl)S(=O)(=O)O

Isomeric SMILES

CC1=CC(=N)C(=O)C=C1NNC2=CC(=C(C=C2)Cl)S(=O)(=O)O

InChI

InChI=1S/C13H12ClN3O4S/c1-7-4-10(15)12(18)6-11(7)17-16-8-2-3-9(14)13(5-8)22(19,20)21/h2-6,15-17H,1H3,(H,19,20,21)