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4-[4-[2-(dimethylaminomethyl)prop-2-enoyl]phenoxy]sulfonyl-2-oxidanyl-benzoic acid

4-[4-[2-(dimethylaminomethyl)prop-2-enoyl]phenoxy]sulfonyl-2-oxidanyl-benzoic acid

Systemtic Name:4-[4-[2-(dimethylaminomethyl)prop-2-enoyl]phenoxy]sulfonyl-2-oxidanyl-benzoic acid
Openeye Name:4-[4-[2-(dimethylaminomethyl)prop-2-enoyl]phenoxy]sulfonyl-2-hydroxy-benzoic acid
CAS Name:4-[4-[2-(dimethylaminomethyl)-1-oxoprop-2-enyl]phenoxy]sulfonyl-2-hydroxybenzoic acid
IUPAC Name:4-[4-[2-(dimethylaminomethyl)prop-2-enoyl]phenoxy]sulfonyl-2-hydroxybenzoic acid
Traditional Name:4-[4-[2-(dimethylaminomethyl)acryloyl]phenoxy]sulfonyl-2-hydroxy-benzoic acid
Formula: C19H19NO7S
MolecularWeight: 405.42166
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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)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)O


InChI

InChI=1S/C19H19NO7S/c1-12(11-20(2)3)18(22)13-4-6-14(7-5-13)27-28(25,26)15-8-9-16(19(23)24)17(21)10-15/h4-10,21H,1,11H2,2-3H3,(H,23,24)


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