methyl 2-[4-(2-chlorophenyl)-5,7-dimethyl-quinolin-2-yl]oxysulfonylpropanoate

Systemtic Name: methyl 2-[4-(2-chlorophenyl)-5,7-dimethyl-quinolin-2-yl]oxysulfonylpropanoate Openeye Name: methyl 2-[[4-(2-chlorophenyl)-5,7-dimethyl-2-quinolyl]oxysulfonyl]propanoate CAS Name: 2-[[4-(2-chlorophenyl)-5,7-dimethyl-2-quinolinyl]oxysulfonyl]propanoic acid methyl ester IUPAC Name: methyl 2-[4-(2-chlorophenyl)-5,7-dimethylquinolin-2-yl]oxysulfonylpropanoate Traditional Name: 2-[[4-(2-chlorophenyl)-5,7-dimethyl-2-quinolyl]oxysulfonyl]propionic acid methyl ester Formula: C21H20ClNO5S MolecularWeight: 433.9052

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=CC(=NC2=C1)OS(=O)(=O)C(C)C(=O)OC)C3=CC=CC=C3Cl)C

Isomeric SMILES

CC1=CC(=C2C(=CC(=NC2=C1)OS(=O)(=O)C(C)C(=O)OC)C3=CC=CC=C3Cl)C

InChI

InChI=1S/C21H20ClNO5S/c1-12-9-13(2)20-16(15-7-5-6-8-17(15)22)11-19(23-18(20)10-12)28-29(25,26)14(3)21(24)27-4/h5-11,14H,1-4H3