[2-[(E)-[(4-chloranyl-2-methyl-pyrazol-3-yl)carbonylhydrazinylidene]methyl]phenyl] benzenesulfonate

Systemtic Name: [2-[(E)-[(4-chloranyl-2-methyl-pyrazol-3-yl)carbonylhydrazinylidene]methyl]phenyl] benzenesulfonate Openeye Name: [2-[(E)-[(4-chloro-2-methyl-pyrazole-3-carbonyl)hydrazono]methyl]phenyl] benzenesulfonate CAS Name: benzenesulfonic acid [2-[(E)-[[(4-chloro-2-methyl-3-pyrazolyl)-oxomethyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [2-[(E)-[(4-chloro-2-methylpyrazole-3-carbonyl)hydrazinylidene]methyl]phenyl] benzenesulfonate Traditional Name: benzenesulfonic acid [2-[(E)-[(4-chloro-2-methyl-pyrazole-3-carbonyl)hydrazono]methyl]phenyl] ester Formula: C18H15ClN4O4S MolecularWeight: 418.8541

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C=N1)Cl)C(=O)NN=CC2=CC=CC=C2OS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CN1C(=C(C=N1)Cl)C(=O)N/N=C/C2=CC=CC=C2OS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C18H15ClN4O4S/c1-23-17(15(19)12-21-23)18(24)22-20-11-13-7-5-6-10-16(13)27-28(25,26)14-8-3-2-4-9-14/h2-12H,1H3,(H,22,24)/b20-11+