3-(4-nitrophenyl)-1,2-thiazole-4-carboxylic acid

Systemtic Name: 3-(4-nitrophenyl)-1,2-thiazole-4-carboxylic acid Openeye Name: 3-(4-nitrophenyl)isothiazole-4-carboxylic acid CAS Name: 3-(4-nitrophenyl)-4-isothiazolecarboxylic acid IUPAC Name: 3-(4-nitrophenyl)-1,2-thiazole-4-carboxylic acid Traditional Name: 3-(4-nitrophenyl)isothiazole-4-carboxylic acid Formula: C10H6N2O4S MolecularWeight: 250.23064

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NSC=C2C(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C2=NSC=C2C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C10H6N2O4S/c13-10(14)8-5-17-11-9(8)6-1-3-7(4-2-6)12(15)16/h1-5H,(H,13,14)