3-[[(3S)-3-(5-fluoranyl-2-methoxy-phenyl)carbonylpiperidin-1-yl]methyl]chromen-4-one

Systemtic Name: 3-[[(3S)-3-(5-fluoranyl-2-methoxy-phenyl)carbonylpiperidin-1-yl]methyl]chromen-4-one Openeye Name: 3-[[(3S)-3-(5-fluoro-2-methoxy-benzoyl)-1-piperidyl]methyl]chromen-4-one CAS Name: 3-[[(3S)-3-[(5-fluoro-2-methoxyphenyl)-oxomethyl]-1-piperidinyl]methyl]-1-benzopyran-4-one IUPAC Name: 3-[[(3S)-3-(5-fluoro-2-methoxybenzoyl)piperidin-1-yl]methyl]chromen-4-one Traditional Name: 3-[[(3S)-3-(5-fluoro-2-methoxy-benzoyl)piperidino]methyl]chromone Formula: C23H22FNO4 MolecularWeight: 395.423483

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)F)C(=O)C2CCCN(C2)CC3=COC4=CC=CC=C4C3=O

Isomeric SMILES

COC1=C(C=C(C=C1)F)C(=O)[C@H]2CCCN(C2)CC3=COC4=CC=CC=C4C3=O

InChI

InChI=1S/C23H22FNO4/c1-28-20-9-8-17(24)11-19(20)22(26)15-5-4-10-25(12-15)13-16-14-29-21-7-3-2-6-18(21)23(16)27/h2-3,6-9,11,14-15H,4-5,10,12-13H2,1H3/t15-/m0/s1