[4-[(E)-(2-cyanoethanoylhydrazinylidene)methyl]phenyl] benzenesulfonate

Systemtic Name: [4-[(E)-(2-cyanoethanoylhydrazinylidene)methyl]phenyl] benzenesulfonate Openeye Name: [4-[(E)-[(2-cyanoacetyl)hydrazono]methyl]phenyl] benzenesulfonate CAS Name: benzenesulfonic acid [4-[(E)-[(2-cyano-1-oxoethyl)hydrazinylidene]methyl]phenyl] ester IUPAC Name: [4-[(E)-[(2-cyanoacetyl)hydrazinylidene]methyl]phenyl] benzenesulfonate Traditional Name: benzenesulfonic acid [4-[(E)-[(2-cyanoacetyl)hydrazono]methyl]phenyl] ester Formula: C16H13N3O4S MolecularWeight: 343.35712

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)C=NNC(=O)CC#N

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)/C=N/NC(=O)CC#N

InChI

InChI=1S/C16H13N3O4S/c17-11-10-16(20)19-18-12-13-6-8-14(9-7-13)23-24(21,22)15-4-2-1-3-5-15/h1-9,12H,10H2,(H,19,20)/b18-12+