[8-[(4-methylpiperidin-1-yl)methyl]-4-oxidanylidene-2-(trifluoromethyl)-3-(2,3,5-trimethylphenoxy)chromen-7-yl] 4-methylbenzoate

Systemtic Name: [8-[(4-methylpiperidin-1-yl)methyl]-4-oxidanylidene-2-(trifluoromethyl)-3-(2,3,5-trimethylphenoxy)chromen-7-yl] 4-methylbenzoate Openeye Name: [8-[(4-methyl-1-piperidyl)methyl]-4-oxo-2-(trifluoromethyl)-3-(2,3,5-trimethylphenoxy)chromen-7-yl] 4-methylbenzoate CAS Name: 4-methylbenzoic acid [8-[(4-methyl-1-piperidinyl)methyl]-4-oxo-2-(trifluoromethyl)-3-(2,3,5-trimethylphenoxy)-1-benzopyran-7-yl] ester IUPAC Name: [8-[(4-methylpiperidin-1-yl)methyl]-4-oxo-2-(trifluoromethyl)-3-(2,3,5-trimethylphenoxy)chromen-7-yl] 4-methylbenzoate Traditional Name: 4-methylbenzoic acid [4-keto-8-[(4-methylpiperidino)methyl]-2-(trifluoromethyl)-3-(2,3,5-trimethylphenoxy)chromen-7-yl] ester Formula: C34H34F3NO5 MolecularWeight: 593.63267

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)CC2=C(C=CC3=C2OC(=C(C3=O)OC4=CC(=CC(=C4C)C)C)C(F)(F)F)OC(=O)C5=CC=C(C=C5)C

Isomeric SMILES

CC1CCN(CC1)CC2=C(C=CC3=C2OC(=C(C3=O)OC4=CC(=CC(=C4C)C)C)C(F)(F)F)OC(=O)C5=CC=C(C=C5)C

InChI

InChI=1S/C34H34F3NO5/c1-19-6-8-24(9-7-19)33(40)42-27-11-10-25-29(39)31(41-28-17-21(3)16-22(4)23(28)5)32(34(35,36)37)43-30(25)26(27)18-38-14-12-20(2)13-15-38/h6-11,16-17,20H,12-15,18H2,1-5H3