[2-[2-(4-cyanophenyl)-2-oxidanylidene-ethanehydrazonoyl]phenyl] benzenesulfonate

Systemtic Name: [2-[2-(4-cyanophenyl)-2-oxidanylidene-ethanehydrazonoyl]phenyl] benzenesulfonate Openeye Name: [2-[2-(4-cyanophenyl)-2-oxo-ethanehydrazonoyl]phenyl] benzenesulfonate CAS Name: benzenesulfonic acid [2-[(1E)-2-(4-cyanophenyl)-1-hydrazinylidene-2-oxoethyl]phenyl] ester IUPAC Name: [2-[2-(4-cyanophenyl)-2-oxoethanehydrazonoyl]phenyl] benzenesulfonate Traditional Name: benzenesulfonic acid [2-[2-(4-cyanophenyl)-2-keto-acetohydrazonoyl]phenyl] ester Formula: C21H15N3O4S MolecularWeight: 405.4265

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)OC2=CC=CC=C2C(=NN)C(=O)C3=CC=C(C=C3)C#N

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)OC2=CC=CC=C2/C(=N\N)/C(=O)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C21H15N3O4S/c22-14-15-10-12-16(13-11-15)21(25)20(24-23)18-8-4-5-9-19(18)28-29(26,27)17-6-2-1-3-7-17/h1-13H,23H2/b24-20+