[5,7-bis(chloranyl)-2-methyl-quinolin-8-yl] 4-methyl-3-piperidin-1-ylsulfonyl-benzoate

Systemtic Name: [5,7-bis(chloranyl)-2-methyl-quinolin-8-yl] 4-methyl-3-piperidin-1-ylsulfonyl-benzoate Openeye Name: (5,7-dichloro-2-methyl-8-quinolyl) 4-methyl-3-(1-piperidylsulfonyl)benzoate CAS Name: 4-methyl-3-(1-piperidinylsulfonyl)benzoic acid (5,7-dichloro-2-methyl-8-quinolinyl) ester IUPAC Name: (5,7-dichloro-2-methylquinolin-8-yl) 4-methyl-3-piperidin-1-ylsulfonylbenzoate Traditional Name: 4-methyl-3-piperidinosulfonyl-benzoic acid (5,7-dichloro-2-methyl-8-quinolyl) ester Formula: C23H22Cl2N2O4S MolecularWeight: 493.40278

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC2=C(C=C(C3=C2N=C(C=C3)C)Cl)Cl)S(=O)(=O)N4CCCCC4

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC2=C(C=C(C3=C2N=C(C=C3)C)Cl)Cl)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C23H22Cl2N2O4S/c1-14-6-8-16(12-20(14)32(29,30)27-10-4-3-5-11-27)23(28)31-22-19(25)13-18(24)17-9-7-15(2)26-21(17)22/h6-9,12-13H,3-5,10-11H2,1-2H3