quinolin-8-yl 2-methoxy-4-methyl-5-propan-2-yl-benzenesulfonate

Systemtic Name: quinolin-8-yl 2-methoxy-4-methyl-5-propan-2-yl-benzenesulfonate Openeye Name: 8-quinolyl 5-isopropyl-2-methoxy-4-methyl-benzenesulfonate CAS Name: 2-methoxy-4-methyl-5-propan-2-ylbenzenesulfonic acid 8-quinolinyl ester IUPAC Name: quinolin-8-yl 2-methoxy-4-methyl-5-propan-2-ylbenzenesulfonate Traditional Name: 5-isopropyl-2-methoxy-4-methyl-benzenesulfonic acid 8-quinolyl ester Formula: C20H21NO4S MolecularWeight: 371.45004

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(C)C)S(=O)(=O)OC2=CC=CC3=C2N=CC=C3)OC

Isomeric SMILES

CC1=CC(=C(C=C1C(C)C)S(=O)(=O)OC2=CC=CC3=C2N=CC=C3)OC

InChI

InChI=1S/C20H21NO4S/c1-13(2)16-12-19(18(24-4)11-14(16)3)26(22,23)25-17-9-5-7-15-8-6-10-21-20(15)17/h5-13H,1-4H3