3-(4-methylphenyl)sulfonyl-7-morpholin-4-ylcarbonyl-2-oxidanyl-1H-quinolin-4-one

Systemtic Name: 3-(4-methylphenyl)sulfonyl-7-morpholin-4-ylcarbonyl-2-oxidanyl-1H-quinolin-4-one Openeye Name: 2-hydroxy-7-(morpholine-4-carbonyl)-3-(p-tolylsulfonyl)-1H-quinolin-4-one CAS Name: 2-hydroxy-3-(4-methylphenyl)sulfonyl-7-[4-morpholinyl(oxo)methyl]-1H-quinolin-4-one IUPAC Name: 2-hydroxy-3-(4-methylphenyl)sulfonyl-7-(morpholine-4-carbonyl)-1H-quinolin-4-one Traditional Name: 2-hydroxy-7-(morpholine-4-carbonyl)-3-tosyl-4-quinolone Formula: C21H20N2O6S MolecularWeight: 428.4583

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2=C(NC3=C(C2=O)C=CC(=C3)C(=O)N4CCOCC4)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=C(NC3=C(C2=O)C=CC(=C3)C(=O)N4CCOCC4)O

InChI

InChI=1S/C21H20N2O6S/c1-13-2-5-15(6-3-13)30(27,28)19-18(24)16-7-4-14(12-17(16)22-20(19)25)21(26)23-8-10-29-11-9-23/h2-7,12H,8-11H2,1H3,(H2,22,24,25)