3-(1-azanyl-1-oxidanylidene-propan-2-yl)sulfonyl-2,5-bis(chloranyl)benzoic acid

Systemtic Name: 3-(1-azanyl-1-oxidanylidene-propan-2-yl)sulfonyl-2,5-bis(chloranyl)benzoic acid Openeye Name: 3-(2-amino-1-methyl-2-oxo-ethyl)sulfonyl-2,5-dichloro-benzoic acid CAS Name: 3-(1-amino-1-oxopropan-2-yl)sulfonyl-2,5-dichlorobenzoic acid IUPAC Name: 3-(1-amino-1-oxopropan-2-yl)sulfonyl-2,5-dichlorobenzoic acid Traditional Name: 3-(2-amino-2-keto-1-methyl-ethyl)sulfonyl-2,5-dichloro-benzoic acid Formula: C10H9Cl2NO5S MolecularWeight: 326.15316

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N)S(=O)(=O)C1=C(C(=CC(=C1)Cl)C(=O)O)Cl

Isomeric SMILES

CC(C(=O)N)S(=O)(=O)C1=C(C(=CC(=C1)Cl)C(=O)O)Cl

InChI

InChI=1S/C10H9Cl2NO5S/c1-4(9(13)14)19(17,18)7-3-5(11)2-6(8(7)12)10(15)16/h2-4H,1H3,(H2,13,14)(H,15,16)