[2-methoxy-4-[(E)-(phenylhydrazinylidene)methyl]phenyl] 2-methyl-5-nitro-benzenesulfonate

Systemtic Name: [2-methoxy-4-[(E)-(phenylhydrazinylidene)methyl]phenyl] 2-methyl-5-nitro-benzenesulfonate Openeye Name: [2-methoxy-4-[(E)-(phenylhydrazono)methyl]phenyl] 2-methyl-5-nitro-benzenesulfonate CAS Name: 2-methyl-5-nitrobenzenesulfonic acid [2-methoxy-4-[(E)-(phenylhydrazinylidene)methyl]phenyl] ester IUPAC Name: [2-methoxy-4-[(E)-(phenylhydrazinylidene)methyl]phenyl] 2-methyl-5-nitrobenzenesulfonate Traditional Name: 2-methyl-5-nitro-benzenesulfonic acid [2-methoxy-4-[(E)-(phenylhydrazono)methyl]phenyl] ester Formula: C21H19N3O6S MolecularWeight: 441.45706

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H19N3O6S/c1-15-8-10-18(24(25)26)13-21(15)31(27,28)30-19-11-9-16(12-20(19)29-2)14-22-23-17-6-4-3-5-7-17/h3-14,23H,1-2H3/b22-14+