(2-chloranyl-7-methoxy-quinolin-3-yl)methyl 2-methyl-1-methylsulfonyl-2,3-dihydroindole-5-carboxylate

Systemtic Name: (2-chloranyl-7-methoxy-quinolin-3-yl)methyl 2-methyl-1-methylsulfonyl-2,3-dihydroindole-5-carboxylate Openeye Name: (2-chloro-7-methoxy-3-quinolyl)methyl 2-methyl-1-methylsulfonyl-indoline-5-carboxylate CAS Name: 2-methyl-1-methylsulfonyl-2,3-dihydroindole-5-carboxylic acid (2-chloro-7-methoxy-3-quinolinyl)methyl ester IUPAC Name: (2-chloro-7-methoxyquinolin-3-yl)methyl 2-methyl-1-methylsulfonyl-2,3-dihydroindole-5-carboxylate Traditional Name: 1-mesyl-2-methyl-indoline-5-carboxylic acid (2-chloro-7-methoxy-3-quinolyl)methyl ester Formula: C22H21ClN2O5S MolecularWeight: 460.93054

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=C(N1S(=O)(=O)C)C=CC(=C2)C(=O)OCC3=C(N=C4C=C(C=CC4=C3)OC)Cl

Isomeric SMILES

CC1CC2=C(N1S(=O)(=O)C)C=CC(=C2)C(=O)OCC3=C(N=C4C=C(C=CC4=C3)OC)Cl

InChI

InChI=1S/C22H21ClN2O5S/c1-13-8-16-10-15(5-7-20(16)25(13)31(3,27)28)22(26)30-12-17-9-14-4-6-18(29-2)11-19(14)24-21(17)23/h4-7,9-11,13H,8,12H2,1-3H3