(3-propan-2-ylphenyl) 8-fluoranylquinoline-5-sulfonate

Systemtic Name: (3-propan-2-ylphenyl) 8-fluoranylquinoline-5-sulfonate Openeye Name: (3-isopropylphenyl) 8-fluoroquinoline-5-sulfonate CAS Name: 8-fluoro-5-quinolinesulfonic acid (3-propan-2-ylphenyl) ester IUPAC Name: (3-propan-2-ylphenyl) 8-fluoroquinoline-5-sulfonate Traditional Name: 8-fluoroquinoline-5-sulfonic acid m-cumenyl ester Formula: C18H16FNO3S MolecularWeight: 345.387943

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=CC=C1)OS(=O)(=O)C2=C3C=CC=NC3=C(C=C2)F

Isomeric SMILES

CC(C)C1=CC(=CC=C1)OS(=O)(=O)C2=C3C=CC=NC3=C(C=C2)F

InChI

InChI=1S/C18H16FNO3S/c1-12(2)13-5-3-6-14(11-13)23-24(21,22)17-9-8-16(19)18-15(17)7-4-10-20-18/h3-12H,1-2H3