[5,7-bis(chloranyl)-2-methyl-quinolin-8-yl] 4-pyrrolidin-1-ylsulfonylbenzoate

Systemtic Name: [5,7-bis(chloranyl)-2-methyl-quinolin-8-yl] 4-pyrrolidin-1-ylsulfonylbenzoate Openeye Name: (5,7-dichloro-2-methyl-8-quinolyl) 4-pyrrolidin-1-ylsulfonylbenzoate CAS Name: 4-(1-pyrrolidinylsulfonyl)benzoic acid (5,7-dichloro-2-methyl-8-quinolinyl) ester IUPAC Name: (5,7-dichloro-2-methylquinolin-8-yl) 4-pyrrolidin-1-ylsulfonylbenzoate Traditional Name: 4-pyrrolidinosulfonylbenzoic acid (5,7-dichloro-2-methyl-8-quinolyl) ester Formula: C21H18Cl2N2O4S MolecularWeight: 465.34962

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H18Cl2N2O4S/c1-13-4-9-16-17(22)12-18(23)20(19(16)24-13)29-21(26)14-5-7-15(8-6-14)30(27,28)25-10-2-3-11-25/h4-9,12H,2-3,10-11H2,1H3