6,7-dimethoxy-3-(phenylsulfonyl)-4-piperidin-1-yl-quinoline

Systemtic Name: 6,7-dimethoxy-3-(phenylsulfonyl)-4-piperidin-1-yl-quinoline Openeye Name: 3-(benzenesulfonyl)-6,7-dimethoxy-4-(1-piperidyl)quinoline CAS Name: 3-(benzenesulfonyl)-6,7-dimethoxy-4-(1-piperidinyl)quinoline IUPAC Name: 3-(benzenesulfonyl)-6,7-dimethoxy-4-piperidin-1-ylquinoline Traditional Name: 3-besyl-6,7-dimethoxy-4-piperidino-quinoline Formula: C22H24N2O4S MolecularWeight: 412.50196

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=C(C=N2)S(=O)(=O)C3=CC=CC=C3)N4CCCCC4)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=C(C=N2)S(=O)(=O)C3=CC=CC=C3)N4CCCCC4)OC

InChI

InChI=1S/C22H24N2O4S/c1-27-19-13-17-18(14-20(19)28-2)23-15-21(22(17)24-11-7-4-8-12-24)29(25,26)16-9-5-3-6-10-16/h3,5-6,9-10,13-15H,4,7-8,11-12H2,1-2H3