(3,4-dichlorophenyl) 4-methylsulfanyl-3-nitro-benzoate

Systemtic Name: (3,4-dichlorophenyl) 4-methylsulfanyl-3-nitro-benzoate Openeye Name: (3,4-dichlorophenyl) 4-methylsulfanyl-3-nitro-benzoate CAS Name: 4-(methylthio)-3-nitrobenzoic acid (3,4-dichlorophenyl) ester IUPAC Name: (3,4-dichlorophenyl) 4-methylsulfanyl-3-nitrobenzoate Traditional Name: 4-(methylthio)-3-nitro-benzoic acid (3,4-dichlorophenyl) ester Formula: C14H9Cl2NO4S MolecularWeight: 358.19656

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=C(C=C1)C(=O)OC2=CC(=C(C=C2)Cl)Cl)[N+](=O)[O-]

Isomeric SMILES

CSC1=C(C=C(C=C1)C(=O)OC2=CC(=C(C=C2)Cl)Cl)[N+](=O)[O-]

InChI

InChI=1S/C14H9Cl2NO4S/c1-22-13-5-2-8(6-12(13)17(19)20)14(18)21-9-3-4-10(15)11(16)7-9/h2-7H,1H3