2-bromanyl-5-thiomorpholin-4-ylsulfonyl-benzoic acid

Systemtic Name: 2-bromanyl-5-thiomorpholin-4-ylsulfonyl-benzoic acid Openeye Name: 2-bromo-5-thiomorpholinosulfonyl-benzoic acid CAS Name: 2-bromo-5-thiomorpholin-4-ylsulfonylbenzoic acid IUPAC Name: 2-bromo-5-thiomorpholin-4-ylsulfonylbenzoic acid Traditional Name: 2-bromo-5-thiomorpholinosulfonyl-benzoic acid Formula: C11H12BrNO4S2 MolecularWeight: 366.25128

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H12BrNO4S2/c12-10-2-1-8(7-9(10)11(14)15)19(16,17)13-3-5-18-6-4-13/h1-2,7H,3-6H2,(H,14,15)