4-[(5-chloranylthiophen-2-yl)methylsulfonyl]benzoate

Systemtic Name: 4-[(5-chloranylthiophen-2-yl)methylsulfonyl]benzoate Openeye Name: 4-[(5-chloro-2-thienyl)methylsulfonyl]benzoate CAS Name: 4-[(5-chloro-2-thiophenyl)methylsulfonyl]benzoate IUPAC Name: 4-[(5-chlorothiophen-2-yl)methylsulfonyl]benzoate Traditional Name: 4-[(5-chloro-2-thienyl)methylsulfonyl]benzoate Formula: C12H8ClO4S2- MolecularWeight: 315.77252

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)[O-])S(=O)(=O)CC2=CC=C(S2)Cl

Isomeric SMILES

C1=CC(=CC=C1C(=O)[O-])S(=O)(=O)CC2=CC=C(S2)Cl

InChI

InChI=1S/C12H9ClO4S2/c13-11-6-3-9(18-11)7-19(16,17)10-4-1-8(2-5-10)12(14)15/h1-6H,7H2,(H,14,15)/p-1