5-aminocarbonyl-2-nitro-benzenecarbothioic S-acid

Systemtic Name: 5-aminocarbonyl-2-nitro-benzenecarbothioic S-acid Openeye Name: 5-carbamoyl-2-nitro-benzenecarbothioic S-acid CAS Name: 5-carbamoyl-2-nitrobenzenecarbothioic S-acid IUPAC Name: 5-carbamoyl-2-nitrobenzenecarbothioic S-acid Traditional Name: 5-carbamoyl-2-nitro-thiobenzoic acid Formula: C8H6N2O4S MolecularWeight: 226.20924

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)N)C(=O)S)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C(C=C1C(=O)N)C(=O)S)[N+](=O)[O-]

InChI

InChI=1S/C8H6N2O4S/c9-7(11)4-1-2-6(10(13)14)5(3-4)8(12)15/h1-3H,(H2,9,11)(H,12,15)