4-nitro-2-[[2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethanoylhydrazinylidene]methyl]phenolate

Systemtic Name: 4-nitro-2-[[2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethanoylhydrazinylidene]methyl]phenolate Openeye Name: 4-nitro-2-[[[2-(1-phenyltetrazol-5-yl)sulfanylacetyl]hydrazono]methyl]phenolate CAS Name: 4-nitro-2-[[[1-oxo-2-[(1-phenyl-5-tetrazolyl)thio]ethyl]hydrazinylidene]methyl]phenolate IUPAC Name: 4-nitro-2-[[[2-(1-phenyltetrazol-5-yl)sulfanylacetyl]hydrazinylidene]methyl]phenolate Traditional Name: 4-nitro-2-[[[2-[(1-phenyltetrazol-5-yl)thio]acetyl]hydrazono]methyl]phenolate Formula: C16H12N7O4S- MolecularWeight: 398.37598

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NN=N2)SCC(=O)NN=CC3=C(C=CC(=C3)[N+](=O)[O-])[O-]

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NN=N2)SCC(=O)NN=CC3=C(C=CC(=C3)[N+](=O)[O-])[O-]

InChI

InChI=1S/C16H13N7O4S/c24-14-7-6-13(23(26)27)8-11(14)9-17-18-15(25)10-28-16-19-20-21-22(16)12-4-2-1-3-5-12/h1-9,24H,10H2,(H,18,25)/p-1