4-diazonio-7-nitro-3-oxidanyl-naphthalene-1-sulfonate

Systemtic Name: 4-diazonio-7-nitro-3-oxidanyl-naphthalene-1-sulfonate Openeye Name: 4-diazonio-3-hydroxy-7-nitro-naphthalene-1-sulfonate CAS Name: 4-diazonio-3-hydroxy-7-nitro-1-naphthalenesulfonate IUPAC Name: 4-diazonio-3-hydroxy-7-nitronaphthalene-1-sulfonate Traditional Name: 4-diazonio-3-hydroxy-7-nitro-naphthalene-1-sulfonate Formula: C10H5N3O6S MolecularWeight: 295.2282

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=CC(=C2C=C1[N+](=O)[O-])S(=O)(=O)[O-])O)[N+]#N

Isomeric SMILES

C1=CC2=C(C(=CC(=C2C=C1[N+](=O)[O-])S(=O)(=O)[O-])O)[N+]#N

InChI

InChI=1S/C10H5N3O6S/c11-12-10-6-2-1-5(13(15)16)3-7(6)9(4-8(10)14)20(17,18)19/h1-4H,(H-,14,17,18,19)