(2-methylquinolin-8-yl) 4-propan-2-ylbenzenesulfonate

Systemtic Name: (2-methylquinolin-8-yl) 4-propan-2-ylbenzenesulfonate Openeye Name: (2-methyl-8-quinolyl) 4-isopropylbenzenesulfonate CAS Name: 4-propan-2-ylbenzenesulfonic acid (2-methyl-8-quinolinyl) ester IUPAC Name: (2-methylquinolin-8-yl) 4-propan-2-ylbenzenesulfonate Traditional Name: 4-isopropylbenzenesulfonic acid (2-methyl-8-quinolyl) ester Formula: C19H19NO3S MolecularWeight: 341.42406

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC=C2OS(=O)(=O)C3=CC=C(C=C3)C(C)C)C=C1

Isomeric SMILES

CC1=NC2=C(C=CC=C2OS(=O)(=O)C3=CC=C(C=C3)C(C)C)C=C1

InChI

InChI=1S/C19H19NO3S/c1-13(2)15-9-11-17(12-10-15)24(21,22)23-18-6-4-5-16-8-7-14(3)20-19(16)18/h4-13H,1-3H3