8-[[(2S)-2-ethylpiperidin-1-yl]methyl]-3-(2-methoxyphenyl)-7-oxidanyl-2-(trifluoromethyl)chromen-4-one

Systemtic Name: 8-[[(2S)-2-ethylpiperidin-1-yl]methyl]-3-(2-methoxyphenyl)-7-oxidanyl-2-(trifluoromethyl)chromen-4-one Openeye Name: 8-[[(2S)-2-ethyl-1-piperidyl]methyl]-7-hydroxy-3-(2-methoxyphenyl)-2-(trifluoromethyl)chromen-4-one CAS Name: 8-[[(2S)-2-ethyl-1-piperidinyl]methyl]-7-hydroxy-3-(2-methoxyphenyl)-2-(trifluoromethyl)-1-benzopyran-4-one IUPAC Name: 8-[[(2S)-2-ethylpiperidin-1-yl]methyl]-7-hydroxy-3-(2-methoxyphenyl)-2-(trifluoromethyl)chromen-4-one Traditional Name: 8-[[(2S)-2-ethylpiperidino]methyl]-7-hydroxy-3-(2-methoxyphenyl)-2-(trifluoromethyl)chromone Formula: C25H26F3NO4 MolecularWeight: 461.47345

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCN1CC2=C(C=CC3=C2OC(=C(C3=O)C4=CC=CC=C4OC)C(F)(F)F)O

Isomeric SMILES

CC[C@H]1CCCCN1CC2=C(C=CC3=C2OC(=C(C3=O)C4=CC=CC=C4OC)C(F)(F)F)O

InChI

InChI=1S/C25H26F3NO4/c1-3-15-8-6-7-13-29(15)14-18-19(30)12-11-17-22(31)21(16-9-4-5-10-20(16)32-2)24(25(26,27)28)33-23(17)18/h4-5,9-12,15,30H,3,6-8,13-14H2,1-2H3/t15-/m0/s1