(2-chloranyl-7-methoxy-quinolin-3-yl)methyl 2-chloranyl-5-pyrrolidin-1-ylsulfonyl-benzoate

Systemtic Name: (2-chloranyl-7-methoxy-quinolin-3-yl)methyl 2-chloranyl-5-pyrrolidin-1-ylsulfonyl-benzoate Openeye Name: (2-chloro-7-methoxy-3-quinolyl)methyl 2-chloro-5-pyrrolidin-1-ylsulfonyl-benzoate CAS Name: 2-chloro-5-(1-pyrrolidinylsulfonyl)benzoic acid (2-chloro-7-methoxy-3-quinolinyl)methyl ester IUPAC Name: (2-chloro-7-methoxyquinolin-3-yl)methyl 2-chloro-5-pyrrolidin-1-ylsulfonylbenzoate Traditional Name: 2-chloro-5-pyrrolidinosulfonyl-benzoic acid (2-chloro-7-methoxy-3-quinolyl)methyl ester Formula: C22H20Cl2N2O5S MolecularWeight: 495.3756

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=NC(=C(C=C2C=C1)COC(=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCCC4)Cl)Cl

Isomeric SMILES

COC1=CC2=NC(=C(C=C2C=C1)COC(=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCCC4)Cl)Cl

InChI

InChI=1S/C22H20Cl2N2O5S/c1-30-16-5-4-14-10-15(21(24)25-20(14)11-16)13-31-22(27)18-12-17(6-7-19(18)23)32(28,29)26-8-2-3-9-26/h4-7,10-12H,2-3,8-9,13H2,1H3