S-(4-chlorophenyl) 2-nitrobenzenecarbothioate

Systemtic Name: S-(4-chlorophenyl) 2-nitrobenzenecarbothioate Openeye Name: S-(4-chlorophenyl) 2-nitrobenzenecarbothioate CAS Name: 2-nitrobenzenecarbothioic acid S-(4-chlorophenyl) ester IUPAC Name: S-(4-chlorophenyl) 2-nitrobenzenecarbothioate Traditional Name: 2-nitrothiobenzoic acid S-(4-chlorophenyl) ester Formula: C13H8ClNO3S MolecularWeight: 293.72552

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H8ClNO3S/c14-9-5-7-10(8-6-9)19-13(16)11-3-1-2-4-12(11)15(17)18/h1-8H