methyl 6-[(4-chlorophenyl)sulfonylamino]-5-pyridin-3-yl-hexanoate

Systemtic Name: methyl 6-[(4-chlorophenyl)sulfonylamino]-5-pyridin-3-yl-hexanoate Openeye Name: methyl 6-[(4-chlorophenyl)sulfonylamino]-5-(3-pyridyl)hexanoate CAS Name: 6-[(4-chlorophenyl)sulfonylamino]-5-(3-pyridinyl)hexanoic acid methyl ester IUPAC Name: methyl 6-[(4-chlorophenyl)sulfonylamino]-5-pyridin-3-ylhexanoate Traditional Name: 6-[(4-chlorophenyl)sulfonylamino]-5-(3-pyridyl)hexanoic acid methyl ester Formula: C18H21ClN2O4S MolecularWeight: 396.88834

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCC(CNS(=O)(=O)C1=CC=C(C=C1)Cl)C2=CN=CC=C2

Isomeric SMILES

COC(=O)CCCC(CNS(=O)(=O)C1=CC=C(C=C1)Cl)C2=CN=CC=C2

InChI

InChI=1S/C18H21ClN2O4S/c1-25-18(22)6-2-4-15(14-5-3-11-20-12-14)13-21-26(23,24)17-9-7-16(19)8-10-17/h3,5,7-12,15,21H,2,4,6,13H2,1H3