methyl 4-[8-[(2-methylpiperidin-1-yl)methyl]-7-oxidanyl-4-oxidanylidene-2-(trifluoromethyl)chromen-3-yl]oxybenzoate

Systemtic Name: methyl 4-[8-[(2-methylpiperidin-1-yl)methyl]-7-oxidanyl-4-oxidanylidene-2-(trifluoromethyl)chromen-3-yl]oxybenzoate Openeye Name: methyl 4-[7-hydroxy-8-[(2-methyl-1-piperidyl)methyl]-4-oxo-2-(trifluoromethyl)chromen-3-yl]oxybenzoate CAS Name: 4-[[7-hydroxy-8-[(2-methyl-1-piperidinyl)methyl]-4-oxo-2-(trifluoromethyl)-1-benzopyran-3-yl]oxy]benzoic acid methyl ester IUPAC Name: methyl 4-[7-hydroxy-8-[(2-methylpiperidin-1-yl)methyl]-4-oxo-2-(trifluoromethyl)chromen-3-yl]oxybenzoate Traditional Name: 4-[7-hydroxy-4-keto-8-[(2-methylpiperidino)methyl]-2-(trifluoromethyl)chromen-3-yl]oxybenzoic acid methyl ester Formula: C25H24F3NO6 MolecularWeight: 491.45637

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1CC2=C(C=CC3=C2OC(=C(C3=O)OC4=CC=C(C=C4)C(=O)OC)C(F)(F)F)O

Isomeric SMILES

CC1CCCCN1CC2=C(C=CC3=C2OC(=C(C3=O)OC4=CC=C(C=C4)C(=O)OC)C(F)(F)F)O

InChI

InChI=1S/C25H24F3NO6/c1-14-5-3-4-12-29(14)13-18-19(30)11-10-17-20(31)22(23(25(26,27)28)35-21(17)18)34-16-8-6-15(7-9-16)24(32)33-2/h6-11,14,30H,3-5,12-13H2,1-2H3