4-[4-(2,4-dichlorophenyl)phenyl]sulfonyl-2,2-dimethyl-thiomorpholine-3-carboxylic acid

Systemtic Name: 4-[4-(2,4-dichlorophenyl)phenyl]sulfonyl-2,2-dimethyl-thiomorpholine-3-carboxylic acid Openeye Name: 4-[4-(2,4-dichlorophenyl)phenyl]sulfonyl-2,2-dimethyl-thiomorpholine-3-carboxylic acid CAS Name: 4-[4-(2,4-dichlorophenyl)phenyl]sulfonyl-2,2-dimethyl-3-thiomorpholinecarboxylic acid IUPAC Name: 4-[4-(2,4-dichlorophenyl)phenyl]sulfonyl-2,2-dimethylthiomorpholine-3-carboxylic acid Traditional Name: 4-[4-(2,4-dichlorophenyl)phenyl]sulfonyl-2,2-dimethyl-thiomorpholine-3-carboxylic acid Formula: C19H19Cl2NO4S2 MolecularWeight: 460.39446

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(N(CCS1)S(=O)(=O)C2=CC=C(C=C2)C3=C(C=C(C=C3)Cl)Cl)C(=O)O)C

Isomeric SMILES

CC1(C(N(CCS1)S(=O)(=O)C2=CC=C(C=C2)C3=C(C=C(C=C3)Cl)Cl)C(=O)O)C

InChI

InChI=1S/C19H19Cl2NO4S2/c1-19(2)17(18(23)24)22(9-10-27-19)28(25,26)14-6-3-12(4-7-14)15-8-5-13(20)11-16(15)21/h3-8,11,17H,9-10H2,1-2H3,(H,23,24)