3-chloranyl-4-nitro-1-benzothiophene-2-carboxylate

Systemtic Name: 3-chloranyl-4-nitro-1-benzothiophene-2-carboxylate Openeye Name: 3-chloro-4-nitro-benzothiophene-2-carboxylate CAS Name: 3-chloro-4-nitro-1-benzothiophene-2-carboxylate IUPAC Name: 3-chloro-4-nitro-1-benzothiophene-2-carboxylate Traditional Name: 3-chloro-4-nitro-benzothiophene-2-carboxylate Formula: C9H3ClNO4S- MolecularWeight: 256.64242

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C2C(=C1)SC(=C2Cl)C(=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C2C(=C1)SC(=C2Cl)C(=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C9H4ClNO4S/c10-7-6-4(11(14)15)2-1-3-5(6)16-8(7)9(12)13/h1-3H,(H,12,13)/p-1