4-chloranyl-3-thiomorpholin-4-ylsulfonyl-benzoic acid

Systemtic Name: 4-chloranyl-3-thiomorpholin-4-ylsulfonyl-benzoic acid Openeye Name: 4-chloro-3-thiomorpholinosulfonyl-benzoic acid CAS Name: 4-chloro-3-thiomorpholin-4-ylsulfonylbenzoic acid IUPAC Name: 4-chloro-3-thiomorpholin-4-ylsulfonylbenzoic acid Traditional Name: 4-chloro-3-thiomorpholinosulfonyl-benzoic acid Formula: C11H12ClNO4S2 MolecularWeight: 321.80028

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Descriptors Computed from Structure

Canonical SMILES:

C1CSCCN1S(=O)(=O)C2=C(C=CC(=C2)C(=O)O)Cl

Isomeric SMILES

C1CSCCN1S(=O)(=O)C2=C(C=CC(=C2)C(=O)O)Cl

InChI

InChI=1S/C11H12ClNO4S2/c12-9-2-1-8(11(14)15)7-10(9)19(16,17)13-3-5-18-6-4-13/h1-2,7H,3-6H2,(H,14,15)