2-bromanyl-5-[2-(cyclopropylamino)-2-oxidanylidene-ethyl]sulfonyl-benzoic acid

Systemtic Name: 2-bromanyl-5-[2-(cyclopropylamino)-2-oxidanylidene-ethyl]sulfonyl-benzoic acid Openeye Name: 2-bromo-5-[2-(cyclopropylamino)-2-oxo-ethyl]sulfonyl-benzoic acid CAS Name: 2-bromo-5-[2-(cyclopropylamino)-2-oxoethyl]sulfonylbenzoic acid IUPAC Name: 2-bromo-5-[2-(cyclopropylamino)-2-oxoethyl]sulfonylbenzoic acid Traditional Name: 2-bromo-5-[2-(cyclopropylamino)-2-keto-ethyl]sulfonyl-benzoic acid Formula: C12H12BrNO5S MolecularWeight: 362.19638

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)CS(=O)(=O)C2=CC(=C(C=C2)Br)C(=O)O

Isomeric SMILES

C1CC1NC(=O)CS(=O)(=O)C2=CC(=C(C=C2)Br)C(=O)O

InChI

InChI=1S/C12H12BrNO5S/c13-10-4-3-8(5-9(10)12(16)17)20(18,19)6-11(15)14-7-1-2-7/h3-5,7H,1-2,6H2,(H,14,15)(H,16,17)