S-(4-methylphenyl) 2-nitrobenzenecarbothioate

Systemtic Name: S-(4-methylphenyl) 2-nitrobenzenecarbothioate Openeye Name: S-(p-tolyl) 2-nitrobenzenecarbothioate CAS Name: 2-nitrobenzenecarbothioic acid S-(4-methylphenyl) ester IUPAC Name: S-(4-methylphenyl) 2-nitrobenzenecarbothioate Traditional Name: 2-nitrothiobenzoic acid S-(p-tolyl) ester Formula: C14H11NO3S MolecularWeight: 273.30704

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC(=O)C2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)SC(=O)C2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C14H11NO3S/c1-10-6-8-11(9-7-10)19-14(16)12-4-2-3-5-13(12)15(17)18/h2-9H,1H3