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4-[4-[2-(dimethylaminomethyl)prop-2-enoyl]phenoxy]sulfonylbenzoic acid
4-[4-[2-(dimethylaminomethyl)prop-2-enoyl]phenoxy]sulfonylbenzoic acid
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Descriptors Computed from Structure
Canonical SMILES:
CN(C)CC(=C)C(=O)C1=CC=C(C=C1)OS(=O)(=O)C2=CC=C(C=C2)C(=O)O
Isomeric SMILES
CN(C)CC(=C)C(=O)C1=CC=C(C=C1)OS(=O)(=O)C2=CC=C(C=C2)C(=O)O
InChI
InChI=1S/C19H19NO6S/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/h4-11H,1,12H2,2-3H3,(H,22,23)
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