2-[4-[2-[(5-chloranyl-2-ethenyl-phenyl)sulfonylamino]ethyl]phenoxy]-2-methyl-propanoic acid

Systemtic Name: 2-[4-[2-[(5-chloranyl-2-ethenyl-phenyl)sulfonylamino]ethyl]phenoxy]-2-methyl-propanoic acid Openeye Name: 2-[4-[2-[(5-chloro-2-vinyl-phenyl)sulfonylamino]ethyl]phenoxy]-2-methyl-propanoic acid CAS Name: 2-[4-[2-[(5-chloro-2-ethenylphenyl)sulfonylamino]ethyl]phenoxy]-2-methylpropanoic acid IUPAC Name: 2-[4-[2-[(5-chloro-2-ethenylphenyl)sulfonylamino]ethyl]phenoxy]-2-methylpropanoic acid Traditional Name: 2-[4-[2-[(5-chloro-2-vinyl-phenyl)sulfonylamino]ethyl]phenoxy]-2-methyl-propionic acid Formula: C20H22ClNO5S MolecularWeight: 423.91038

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)O)OC1=CC=C(C=C1)CCNS(=O)(=O)C2=C(C=CC(=C2)Cl)C=C

Isomeric SMILES

CC(C)(C(=O)O)OC1=CC=C(C=C1)CCNS(=O)(=O)C2=C(C=CC(=C2)Cl)C=C

InChI

InChI=1S/C20H22ClNO5S/c1-4-15-7-8-16(21)13-18(15)28(25,26)22-12-11-14-5-9-17(10-6-14)27-20(2,3)19(23)24/h4-10,13,22H,1,11-12H2,2-3H3,(H,23,24)