methyl 4-[5-chloranyl-1-(6-morpholin-4-ylpyridin-3-yl)sulfonyl-indol-2-yl]butanoate

Systemtic Name: methyl 4-[5-chloranyl-1-(6-morpholin-4-ylpyridin-3-yl)sulfonyl-indol-2-yl]butanoate Openeye Name: methyl 4-[5-chloro-1-[(6-morpholino-3-pyridyl)sulfonyl]indol-2-yl]butanoate CAS Name: 4-[5-chloro-1-[[6-(4-morpholinyl)-3-pyridinyl]sulfonyl]-2-indolyl]butanoic acid methyl ester IUPAC Name: methyl 4-[5-chloro-1-(6-morpholin-4-ylpyridin-3-yl)sulfonylindol-2-yl]butanoate Traditional Name: 4-[5-chloro-1-[(6-morpholino-3-pyridyl)sulfonyl]indol-2-yl]butyric acid methyl ester Formula: C22H24ClN3O5S MolecularWeight: 477.96106

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCC1=CC2=C(N1S(=O)(=O)C3=CN=C(C=C3)N4CCOCC4)C=CC(=C2)Cl

Isomeric SMILES

COC(=O)CCCC1=CC2=C(N1S(=O)(=O)C3=CN=C(C=C3)N4CCOCC4)C=CC(=C2)Cl

InChI

InChI=1S/C22H24ClN3O5S/c1-30-22(27)4-2-3-18-14-16-13-17(23)5-7-20(16)26(18)32(28,29)19-6-8-21(24-15-19)25-9-11-31-12-10-25/h5-8,13-15H,2-4,9-12H2,1H3