[4-[7-(2,2-dimethylpropanoyloxy)-2-[4-(2-piperidin-1-ylethoxy)phenyl]-4-(trifluoromethyl)-2H-chromen-3-yl]phenyl] 2,2-dimethylpropanoate

Systemtic Name: [4-[7-(2,2-dimethylpropanoyloxy)-2-[4-(2-piperidin-1-ylethoxy)phenyl]-4-(trifluoromethyl)-2H-chromen-3-yl]phenyl] 2,2-dimethylpropanoate Openeye Name: [4-[7-(2,2-dimethylpropanoyloxy)-2-[4-[2-(1-piperidyl)ethoxy]phenyl]-4-(trifluoromethyl)-2H-chromen-3-yl]phenyl] 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid [4-[7-(2,2-dimethyl-1-oxopropoxy)-2-[4-[2-(1-piperidinyl)ethoxy]phenyl]-4-(trifluoromethyl)-2H-1-benzopyran-3-yl]phenyl] ester IUPAC Name: [4-[7-(2,2-dimethylpropanoyloxy)-2-[4-(2-piperidin-1-ylethoxy)phenyl]-4-(trifluoromethyl)-2H-chromen-3-yl]phenyl] 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid [4-[2-[4-(2-piperidinoethoxy)phenyl]-7-pivaloyloxy-4-(trifluoromethyl)-2H-chromen-3-yl]phenyl] ester Formula: C39H44F3NO6 MolecularWeight: 679.76497

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)OC1=CC=C(C=C1)C2=C(C3=C(C=C(C=C3)OC(=O)C(C)(C)C)OC2C4=CC=C(C=C4)OCCN5CCCCC5)C(F)(F)F

Isomeric SMILES

CC(C)(C)C(=O)OC1=CC=C(C=C1)C2=C(C3=C(C=C(C=C3)OC(=O)C(C)(C)C)OC2C4=CC=C(C=C4)OCCN5CCCCC5)C(F)(F)F

InChI

InChI=1S/C39H44F3NO6/c1-37(2,3)35(44)47-28-16-10-25(11-17-28)32-33(39(40,41)42)30-19-18-29(48-36(45)38(4,5)6)24-31(30)49-34(32)26-12-14-27(15-13-26)46-23-22-43-20-8-7-9-21-43/h10-19,24,34H,7-9,20-23H2,1-6H3