3-chloranylsulfonyl-4-(dimethylamino)benzoic acid

Systemtic Name: 3-chloranylsulfonyl-4-(dimethylamino)benzoic acid Openeye Name: 3-chlorosulfonyl-4-(dimethylamino)benzoic acid CAS Name: 3-chlorosulfonyl-4-(dimethylamino)benzoic acid IUPAC Name: 3-chlorosulfonyl-4-(dimethylamino)benzoic acid Traditional Name: 3-chlorosulfonyl-4-(dimethylamino)benzoic acid Formula: C9H10ClNO4S MolecularWeight: 263.698

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C(C=C(C=C1)C(=O)O)S(=O)(=O)Cl

Isomeric SMILES

CN(C)C1=C(C=C(C=C1)C(=O)O)S(=O)(=O)Cl

InChI

InChI=1S/C9H10ClNO4S/c1-11(2)7-4-3-6(9(12)13)5-8(7)16(10,14)15/h3-5H,1-2H3,(H,12,13)