[4-[(E)-[(2-methoxy-4-methyl-phenyl)carbonylhydrazinylidene]methyl]phenyl] 4-methyl-3-nitro-benzenesulfonate

Systemtic Name: [4-[(E)-[(2-methoxy-4-methyl-phenyl)carbonylhydrazinylidene]methyl]phenyl] 4-methyl-3-nitro-benzenesulfonate Openeye Name: [4-[(E)-[(2-methoxy-4-methyl-benzoyl)hydrazono]methyl]phenyl] 4-methyl-3-nitro-benzenesulfonate CAS Name: 4-methyl-3-nitrobenzenesulfonic acid [4-[(E)-[[(2-methoxy-4-methylphenyl)-oxomethyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [4-[(E)-[(2-methoxy-4-methylbenzoyl)hydrazinylidene]methyl]phenyl] 4-methyl-3-nitrobenzenesulfonate Traditional Name: 4-methyl-3-nitro-benzenesulfonic acid [4-[(E)-[(2-methoxy-4-methyl-benzoyl)hydrazono]methyl]phenyl] ester Formula: C23H21N3O7S MolecularWeight: 483.49374

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(=O)NN=CC2=CC=C(C=C2)OS(=O)(=O)C3=CC(=C(C=C3)C)[N+](=O)[O-])OC

Isomeric SMILES

CC1=CC(=C(C=C1)C(=O)N/N=C/C2=CC=C(C=C2)OS(=O)(=O)C3=CC(=C(C=C3)C)[N+](=O)[O-])OC

InChI

InChI=1S/C23H21N3O7S/c1-15-4-11-20(22(12-15)32-3)23(27)25-24-14-17-6-8-18(9-7-17)33-34(30,31)19-10-5-16(2)21(13-19)26(28)29/h4-14H,1-3H3,(H,25,27)/b24-14+