methyl (4R)-8-[(4-chlorophenyl)sulfonylamino]-4-(2-pyridin-3-yloxyethyl)octanoate

Systemtic Name: methyl (4R)-8-[(4-chlorophenyl)sulfonylamino]-4-(2-pyridin-3-yloxyethyl)octanoate Openeye Name: methyl (4R)-8-[(4-chlorophenyl)sulfonylamino]-4-[2-(3-pyridyloxy)ethyl]octanoate CAS Name: (4R)-8-[(4-chlorophenyl)sulfonylamino]-4-[2-(3-pyridinyloxy)ethyl]octanoic acid methyl ester IUPAC Name: methyl (4R)-8-[(4-chlorophenyl)sulfonylamino]-4-(2-pyridin-3-yloxyethyl)octanoate Traditional Name: (4R)-8-[(4-chlorophenyl)sulfonylamino]-4-[2-(3-pyridyloxy)ethyl]caprylic acid methyl ester Formula: C22H29ClN2O5S MolecularWeight: 468.99406

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC(CCCCNS(=O)(=O)C1=CC=C(C=C1)Cl)CCOC2=CN=CC=C2

Isomeric SMILES

COC(=O)CC[C@@H](CCCCNS(=O)(=O)C1=CC=C(C=C1)Cl)CCOC2=CN=CC=C2

InChI

InChI=1S/C22H29ClN2O5S/c1-29-22(26)12-7-18(13-16-30-20-6-4-14-24-17-20)5-2-3-15-25-31(27,28)21-10-8-19(23)9-11-21/h4,6,8-11,14,17-18,25H,2-3,5,7,12-13,15-16H2,1H3/t18-/m1/s1