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

Systemtic Name: [5,7-bis(chloranyl)-2-methyl-quinolin-8-yl] 4-methoxy-3-pyrrolidin-1-ylsulfonyl-benzoate Openeye Name: (5,7-dichloro-2-methyl-8-quinolyl) 4-methoxy-3-pyrrolidin-1-ylsulfonyl-benzoate CAS Name: 4-methoxy-3-(1-pyrrolidinylsulfonyl)benzoic acid (5,7-dichloro-2-methyl-8-quinolinyl) ester IUPAC Name: (5,7-dichloro-2-methylquinolin-8-yl) 4-methoxy-3-pyrrolidin-1-ylsulfonylbenzoate Traditional Name: 4-methoxy-3-pyrrolidinosulfonyl-benzoic acid (5,7-dichloro-2-methyl-8-quinolyl) ester Formula: C22H20Cl2N2O5S MolecularWeight: 495.3756

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C1)C(=CC(=C2OC(=O)C3=CC(=C(C=C3)OC)S(=O)(=O)N4CCCC4)Cl)Cl

Isomeric SMILES

CC1=NC2=C(C=C1)C(=CC(=C2OC(=O)C3=CC(=C(C=C3)OC)S(=O)(=O)N4CCCC4)Cl)Cl

InChI

InChI=1S/C22H20Cl2N2O5S/c1-13-5-7-15-16(23)12-17(24)21(20(15)25-13)31-22(27)14-6-8-18(30-2)19(11-14)32(28,29)26-9-3-4-10-26/h5-8,11-12H,3-4,9-10H2,1-2H3