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4-[4-[3-(dimethylamino)-2-methyl-propanoyl]phenoxy]sulfonylbenzoic acid hydrochloride
4-[4-[3-(dimethylamino)-2-methyl-propanoyl]phenoxy]sulfonylbenzoic acid hydrochloride
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Descriptors Computed from Structure
Canonical SMILES:
CC(CN(C)C)C(=O)C1=CC=C(C=C1)OS(=O)(=O)C2=CC=C(C=C2)C(=O)O.Cl
Isomeric SMILES
CC(CN(C)C)C(=O)C1=CC=C(C=C1)OS(=O)(=O)C2=CC=C(C=C2)C(=O)O.Cl
InChI
InChI=1S/C19H21NO6S.ClH/c1-13(12-20(2)3)18(21)14-4-8-16(9-5-14)26-27(24,25)17-10-6-15(7-11-17)19(22)23;/h4-11,13H,12H2,1-3H3,(H,22,23);1H
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