2-ethanoyl-7-nitro-3-(4-sulfamoylphenyl)imino-inden-1-olate

Systemtic Name: 2-ethanoyl-7-nitro-3-(4-sulfamoylphenyl)imino-inden-1-olate Openeye Name: 2-acetyl-7-nitro-3-(4-sulfamoylphenyl)imino-inden-1-olate CAS Name: 2-acetyl-7-nitro-3-(4-sulfamoylphenyl)imino-1-indenolate IUPAC Name: 2-acetyl-7-nitro-3-(4-sulfamoylphenyl)iminoinden-1-olate Traditional Name: 2-acetyl-7-nitro-3-(4-sulfamoylphenyl)imino-inden-1-olate Formula: C17H12N3O6S- MolecularWeight: 386.35868

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H13N3O6S/c1-9(21)14-16(19-10-5-7-11(8-6-10)27(18,25)26)12-3-2-4-13(20(23)24)15(12)17(14)22/h2-8,22H,1H3,(H2,18,25,26)/p-1