(2-chloranylquinolin-3-yl)methyl 4-chloranyl-3-pyrrolidin-1-ylsulfonyl-benzoate

Systemtic Name: (2-chloranylquinolin-3-yl)methyl 4-chloranyl-3-pyrrolidin-1-ylsulfonyl-benzoate Openeye Name: (2-chloro-3-quinolyl)methyl 4-chloro-3-pyrrolidin-1-ylsulfonyl-benzoate CAS Name: 4-chloro-3-(1-pyrrolidinylsulfonyl)benzoic acid (2-chloro-3-quinolinyl)methyl ester IUPAC Name: (2-chloroquinolin-3-yl)methyl 4-chloro-3-pyrrolidin-1-ylsulfonylbenzoate Traditional Name: 4-chloro-3-pyrrolidinosulfonyl-benzoic acid (2-chloro-3-quinolyl)methyl ester Formula: C21H18Cl2N2O4S MolecularWeight: 465.34962

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)OCC3=CC4=CC=CC=C4N=C3Cl)Cl

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)OCC3=CC4=CC=CC=C4N=C3Cl)Cl

InChI

InChI=1S/C21H18Cl2N2O4S/c22-17-8-7-15(12-19(17)30(27,28)25-9-3-4-10-25)21(26)29-13-16-11-14-5-1-2-6-18(14)24-20(16)23/h1-2,5-8,11-12H,3-4,9-10,13H2