methyl 8-[(4-chlorophenyl)sulfonylamino]-4-(2-methylsulfonyloxyethyl)octanoate

Systemtic Name: methyl 8-[(4-chlorophenyl)sulfonylamino]-4-(2-methylsulfonyloxyethyl)octanoate Openeye Name: methyl 8-[(4-chlorophenyl)sulfonylamino]-4-(2-methylsulfonyloxyethyl)octanoate CAS Name: 8-[(4-chlorophenyl)sulfonylamino]-4-(2-methylsulfonyloxyethyl)octanoic acid methyl ester IUPAC Name: methyl 8-[(4-chlorophenyl)sulfonylamino]-4-(2-methylsulfonyloxyethyl)octanoate Traditional Name: 8-[(4-chlorophenyl)sulfonylamino]-4-(2-methylsulfonyloxyethyl)caprylic acid methyl ester Formula: C18H28ClNO7S2 MolecularWeight: 470.00042

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC(CCCCNS(=O)(=O)C1=CC=C(C=C1)Cl)CCOS(=O)(=O)C

Isomeric SMILES

COC(=O)CCC(CCCCNS(=O)(=O)C1=CC=C(C=C1)Cl)CCOS(=O)(=O)C

InChI

InChI=1S/C18H28ClNO7S2/c1-26-18(21)11-6-15(12-14-27-28(2,22)23)5-3-4-13-20-29(24,25)17-9-7-16(19)8-10-17/h7-10,15,20H,3-6,11-14H2,1-2H3