[4-[(E)-[(4-nitrophenyl)hydrazinylidene]methyl]phenyl] 4-methylbenzenesulfonate

Systemtic Name: [4-[(E)-[(4-nitrophenyl)hydrazinylidene]methyl]phenyl] 4-methylbenzenesulfonate Openeye Name: [4-[(E)-[(4-nitrophenyl)hydrazono]methyl]phenyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [4-[(E)-[(4-nitrophenyl)hydrazinylidene]methyl]phenyl] ester IUPAC Name: [4-[(E)-[(4-nitrophenyl)hydrazinylidene]methyl]phenyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [4-[(E)-[(4-nitrophenyl)hydrazono]methyl]phenyl] ester Formula: C20H17N3O5S MolecularWeight: 411.43108

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)C=NNC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)/C=N/NC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H17N3O5S/c1-15-2-12-20(13-3-15)29(26,27)28-19-10-4-16(5-11-19)14-21-22-17-6-8-18(9-7-17)23(24)25/h2-14,22H,1H3/b21-14+