2-[1-[2-fluoranyl-4-(2-methylsulfonylphenyl)phenyl]-2-oxidanylidene-piperidin-3-yl]oxy-5-methoxy-benzaldehyde

Systemtic Name: 2-[1-[2-fluoranyl-4-(2-methylsulfonylphenyl)phenyl]-2-oxidanylidene-piperidin-3-yl]oxy-5-methoxy-benzaldehyde Openeye Name: 2-[[1-[2-fluoro-4-(2-methylsulfonylphenyl)phenyl]-2-oxo-3-piperidyl]oxy]-5-methoxy-benzaldehyde CAS Name: 2-[[1-[2-fluoro-4-(2-methylsulfonylphenyl)phenyl]-2-oxo-3-piperidinyl]oxy]-5-methoxybenzaldehyde IUPAC Name: 2-[1-[2-fluoro-4-(2-methylsulfonylphenyl)phenyl]-2-oxopiperidin-3-yl]oxy-5-methoxybenzaldehyde Traditional Name: 2-[[1-[2-fluoro-4-(2-mesylphenyl)phenyl]-2-keto-3-piperidyl]oxy]-5-methoxy-benzaldehyde Formula: C26H24FNO6S MolecularWeight: 497.535263

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC2CCCN(C2=O)C3=C(C=C(C=C3)C4=CC=CC=C4S(=O)(=O)C)F)C=O

Isomeric SMILES

COC1=CC(=C(C=C1)OC2CCCN(C2=O)C3=C(C=C(C=C3)C4=CC=CC=C4S(=O)(=O)C)F)C=O

InChI

InChI=1S/C26H24FNO6S/c1-33-19-10-12-23(18(14-19)16-29)34-24-7-5-13-28(26(24)30)22-11-9-17(15-21(22)27)20-6-3-4-8-25(20)35(2,31)32/h3-4,6,8-12,14-16,24H,5,7,13H2,1-2H3