(3-chloranyl-4-fluoranyl-phenyl) 3-methylquinoline-8-sulfonate

Systemtic Name: (3-chloranyl-4-fluoranyl-phenyl) 3-methylquinoline-8-sulfonate Openeye Name: (3-chloro-4-fluoro-phenyl) 3-methylquinoline-8-sulfonate CAS Name: 3-methyl-8-quinolinesulfonic acid (3-chloro-4-fluorophenyl) ester IUPAC Name: (3-chloro-4-fluorophenyl) 3-methylquinoline-8-sulfonate Traditional Name: 3-methylquinoline-8-sulfonic acid (3-chloro-4-fluoro-phenyl) ester Formula: C16H11ClFNO3S MolecularWeight: 351.779843

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C2C(=C1)C=CC=C2S(=O)(=O)OC3=CC(=C(C=C3)F)Cl

Isomeric SMILES

CC1=CN=C2C(=C1)C=CC=C2S(=O)(=O)OC3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C16H11ClFNO3S/c1-10-7-11-3-2-4-15(16(11)19-9-10)23(20,21)22-12-5-6-14(18)13(17)8-12/h2-9H,1H3