3-chloranylsulfonyl-4-phenyl-5-(thiophen-3-ylmethoxy)benzoic acid

Systemtic Name: 3-chloranylsulfonyl-4-phenyl-5-(thiophen-3-ylmethoxy)benzoic acid Openeye Name: 3-chlorosulfonyl-4-phenyl-5-(3-thienylmethoxy)benzoic acid CAS Name: 3-chlorosulfonyl-4-phenyl-5-(3-thiophenylmethoxy)benzoic acid IUPAC Name: 3-chlorosulfonyl-4-phenyl-5-(thiophen-3-ylmethoxy)benzoic acid Traditional Name: 3-chlorosulfonyl-4-phenyl-5-(3-thenyloxy)benzoic acid Formula: C18H13ClO5S2 MolecularWeight: 408.87582

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C=C(C=C2S(=O)(=O)Cl)C(=O)O)OCC3=CSC=C3

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C=C(C=C2S(=O)(=O)Cl)C(=O)O)OCC3=CSC=C3

InChI

InChI=1S/C18H13ClO5S2/c19-26(22,23)16-9-14(18(20)21)8-15(24-10-12-6-7-25-11-12)17(16)13-4-2-1-3-5-13/h1-9,11H,10H2,(H,20,21)