2-chloranyl-2-[4-(2-methylprop-2-enoylamino)phenyl]sulfonyl-ethanoic acid

Systemtic Name: 2-chloranyl-2-[4-(2-methylprop-2-enoylamino)phenyl]sulfonyl-ethanoic acid Openeye Name: 2-chloro-2-[4-(2-methylprop-2-enoylamino)phenyl]sulfonyl-acetic acid CAS Name: 2-chloro-2-[4-[(2-methyl-1-oxoprop-2-enyl)amino]phenyl]sulfonylacetic acid IUPAC Name: 2-chloro-2-[4-(2-methylprop-2-enoylamino)phenyl]sulfonylacetic acid Traditional Name: 2-chloro-2-(4-methacrylamidophenyl)sulfonyl-acetic acid Formula: C12H12ClNO5S MolecularWeight: 317.74538

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C(=O)NC1=CC=C(C=C1)S(=O)(=O)C(C(=O)O)Cl

Isomeric SMILES

CC(=C)C(=O)NC1=CC=C(C=C1)S(=O)(=O)C(C(=O)O)Cl

InChI

InChI=1S/C12H12ClNO5S/c1-7(2)11(15)14-8-3-5-9(6-4-8)20(18,19)10(13)12(16)17/h3-6,10H,1H2,2H3,(H,14,15)(H,16,17)