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

Systemtic Name: [4-[(E)-[(3-oxidanylnaphthalen-2-yl)carbonylhydrazinylidene]methyl]phenyl] 4-methyl-3-nitro-benzenesulfonate Openeye Name: [4-[(E)-[(3-hydroxynaphthalene-2-carbonyl)hydrazono]methyl]phenyl] 4-methyl-3-nitro-benzenesulfonate CAS Name: 4-methyl-3-nitrobenzenesulfonic acid [4-[(E)-[[(3-hydroxy-2-naphthalenyl)-oxomethyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [4-[(E)-[(3-hydroxynaphthalene-2-carbonyl)hydrazinylidene]methyl]phenyl] 4-methyl-3-nitrobenzenesulfonate Traditional Name: 4-methyl-3-nitro-benzenesulfonic acid [4-[(E)-[(3-hydroxy-2-naphthoyl)hydrazono]methyl]phenyl] ester Formula: C25H19N3O7S MolecularWeight: 505.49926

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)C=NNC(=O)C3=CC4=CC=CC=C4C=C3O)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)/C=N/NC(=O)C3=CC4=CC=CC=C4C=C3O)[N+](=O)[O-]

InChI

InChI=1S/C25H19N3O7S/c1-16-6-11-21(14-23(16)28(31)32)36(33,34)35-20-9-7-17(8-10-20)15-26-27-25(30)22-12-18-4-2-3-5-19(18)13-24(22)29/h2-15,29H,1H3,(H,27,30)/b26-15+