4-[2-[(4-nitrophenyl)carbamothioyl]hydrazinyl]benzoic acid

Systemtic Name: 4-[2-[(4-nitrophenyl)carbamothioyl]hydrazinyl]benzoic acid Openeye Name: 4-[2-[(4-nitrophenyl)carbamothioyl]hydrazino]benzoic acid CAS Name: 4-[[(4-nitroanilino)-sulfanylidenemethyl]hydrazo]benzoic acid IUPAC Name: 4-[2-[(4-nitrophenyl)carbamothioyl]hydrazinyl]benzoic acid Traditional Name: 4-[N'-[(4-nitrophenyl)thiocarbamoyl]hydrazino]benzoic acid Formula: C14H12N4O4S MolecularWeight: 332.33448

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)O)NNC(=S)NC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(=O)O)NNC(=S)NC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H12N4O4S/c19-13(20)9-1-3-11(4-2-9)16-17-14(23)15-10-5-7-12(8-6-10)18(21)22/h1-8,16H,(H,19,20)(H2,15,17,23)