methyl 8-[(4-chlorophenyl)sulfonylamino]-8-pyridin-3-yl-octanoate

Systemtic Name: methyl 8-[(4-chlorophenyl)sulfonylamino]-8-pyridin-3-yl-octanoate Openeye Name: methyl 8-[(4-chlorophenyl)sulfonylamino]-8-(3-pyridyl)octanoate CAS Name: 8-[(4-chlorophenyl)sulfonylamino]-8-(3-pyridinyl)octanoic acid methyl ester IUPAC Name: methyl 8-[(4-chlorophenyl)sulfonylamino]-8-pyridin-3-yloctanoate Traditional Name: 8-[(4-chlorophenyl)sulfonylamino]-8-(3-pyridyl)caprylic acid methyl ester Formula: C20H25ClN2O4S MolecularWeight: 424.9415

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCCCC(C1=CN=CC=C1)NS(=O)(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

COC(=O)CCCCCCC(C1=CN=CC=C1)NS(=O)(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C20H25ClN2O4S/c1-27-20(24)9-5-3-2-4-8-19(16-7-6-14-22-15-16)23-28(25,26)18-12-10-17(21)11-13-18/h6-7,10-15,19,23H,2-5,8-9H2,1H3