4-butyl-5,7-dimethoxy-1-(4-methylphenyl)sulfonyl-2H-quinoline

Systemtic Name: 4-butyl-5,7-dimethoxy-1-(4-methylphenyl)sulfonyl-2H-quinoline Openeye Name: 4-butyl-5,7-dimethoxy-1-(p-tolylsulfonyl)-2H-quinoline CAS Name: 4-butyl-5,7-dimethoxy-1-(4-methylphenyl)sulfonyl-2H-quinoline IUPAC Name: 4-butyl-5,7-dimethoxy-1-(4-methylphenyl)sulfonyl-2H-quinoline Traditional Name: 4-butyl-5,7-dimethoxy-1-tosyl-2H-quinoline Formula: C22H27NO4S MolecularWeight: 401.51908

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CCN(C2=CC(=CC(=C12)OC)OC)S(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCCCC1=CCN(C2=CC(=CC(=C12)OC)OC)S(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C22H27NO4S/c1-5-6-7-17-12-13-23(28(24,25)19-10-8-16(2)9-11-19)20-14-18(26-3)15-21(27-4)22(17)20/h8-12,14-15H,5-7,13H2,1-4H3