6-ethoxy-1-[(2-fluorophenyl)methyl]-3-(4-methylphenyl)sulfonyl-quinolin-4-one

Systemtic Name: 6-ethoxy-1-[(2-fluorophenyl)methyl]-3-(4-methylphenyl)sulfonyl-quinolin-4-one Openeye Name: 6-ethoxy-1-[(2-fluorophenyl)methyl]-3-(p-tolylsulfonyl)quinolin-4-one CAS Name: 6-ethoxy-1-[(2-fluorophenyl)methyl]-3-(4-methylphenyl)sulfonyl-4-quinolinone IUPAC Name: 6-ethoxy-1-[(2-fluorophenyl)methyl]-3-(4-methylphenyl)sulfonylquinolin-4-one Traditional Name: 6-ethoxy-1-(2-fluorobenzyl)-3-tosyl-4-quinolone Formula: C25H22FNO4S MolecularWeight: 451.509883

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N(C=C(C2=O)S(=O)(=O)C3=CC=C(C=C3)C)CC4=CC=CC=C4F

Isomeric SMILES

CCOC1=CC2=C(C=C1)N(C=C(C2=O)S(=O)(=O)C3=CC=C(C=C3)C)CC4=CC=CC=C4F

InChI

InChI=1S/C25H22FNO4S/c1-3-31-19-10-13-23-21(14-19)25(28)24(32(29,30)20-11-8-17(2)9-12-20)16-27(23)15-18-6-4-5-7-22(18)26/h4-14,16H,3,15H2,1-2H3