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6-(3-nitrophenyl)sulfanylpyrazine-2-carboxylic acid

6-(3-nitrophenyl)sulfanylpyrazine-2-carboxylic acid

Systemtic Name:6-(3-nitrophenyl)sulfanylpyrazine-2-carboxylic acid
Openeye Name:6-(3-nitrophenyl)sulfanylpyrazine-2-carboxylic acid
CAS Name:6-[(3-nitrophenyl)thio]-2-pyrazinecarboxylic acid
IUPAC Name:6-(3-nitrophenyl)sulfanylpyrazine-2-carboxylic acid
Traditional Name:6-[(3-nitrophenyl)thio]pyrazinoic acid
Formula: C11H7N3O4S
MolecularWeight: 277.25598
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)SC2=NC(=CN=C2)C(=O)O)[N+](=O)[O-]


Isomeric SMILES

C1=CC(=CC(=C1)SC2=NC(=CN=C2)C(=O)O)[N+](=O)[O-]


InChI

InChI=1S/C11H7N3O4S/c15-11(16)9-5-12-6-10(13-9)19-8-3-1-2-7(4-8)14(17)18/h1-6H,(H,15,16)


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