4-methoxy-2-nitro-5-[5-(phenylazanylcarbamoyl)-2H-1,2,3,4-tetrazol-1-ium-1-yl]benzenesulfonic acid hydroxide

Systemtic Name: 4-methoxy-2-nitro-5-[5-(phenylazanylcarbamoyl)-2H-1,2,3,4-tetrazol-1-ium-1-yl]benzenesulfonic acid hydroxide Openeye Name: 5-[5-(anilinocarbamoyl)-2H-tetrazol-1-ium-1-yl]-4-methoxy-2-nitro-benzenesulfonic acid hydroxide CAS Name: 4-methoxy-2-nitro-5-[5-[oxo-(phenylhydrazo)methyl]-2H-tetrazol-1-ium-1-yl]benzenesulfonic acid hydroxide IUPAC Name: 5-[5-(anilinocarbamoyl)-2H-tetrazol-1-ium-1-yl]-4-methoxy-2-nitrobenzenesulfonic acid hydroxide Traditional Name: 5-[5-(anilinocarbamoyl)-2H-tetrazol-1-ium-1-yl]-4-methoxy-2-nitro-besylic acid hydroxide Formula: C15H15N7O8S MolecularWeight: 453.3867

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1[N+]2=C(N=NN2)C(=O)NNC3=CC=CC=C3)S(=O)(=O)O)[N+](=O)[O-].[OH-]

Isomeric SMILES

COC1=CC(=C(C=C1[N+]2=C(N=NN2)C(=O)NNC3=CC=CC=C3)S(=O)(=O)O)[N+](=O)[O-].[OH-]

InChI

InChI=1S/C15H13N7O7S.H2O/c1-29-12-7-11(22(24)25)13(30(26,27)28)8-10(12)21-14(17-19-20-21)15(23)18-16-9-5-3-2-4-6-9;/h2-8H,1H3,(H3,16,17,18,19,20,23,26,27,28);1H2