S-(4-methylphenyl) 4-(4-chloranylphenoxy)-3-nitro-benzenecarbothioate

Systemtic Name: S-(4-methylphenyl) 4-(4-chloranylphenoxy)-3-nitro-benzenecarbothioate Openeye Name: S-(p-tolyl) 4-(4-chlorophenoxy)-3-nitro-benzenecarbothioate CAS Name: 4-(4-chlorophenoxy)-3-nitrobenzenecarbothioic acid S-(4-methylphenyl) ester IUPAC Name: S-(4-methylphenyl) 4-(4-chlorophenoxy)-3-nitrobenzenecarbothioate Traditional Name: 4-(4-chlorophenoxy)-3-nitro-thiobenzoic acid S-(p-tolyl) ester Formula: C20H14ClNO4S MolecularWeight: 399.84746

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC(=O)C2=CC(=C(C=C2)OC3=CC=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)SC(=O)C2=CC(=C(C=C2)OC3=CC=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C20H14ClNO4S/c1-13-2-9-17(10-3-13)27-20(23)14-4-11-19(18(12-14)22(24)25)26-16-7-5-15(21)6-8-16/h2-12H,1H3