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

Systemtic Name: [8-[(dipropylamino)methyl]-4-oxidanylidene-2-(trifluoromethyl)-3-(2,3,5-trimethylphenoxy)chromen-7-yl] 4-methylbenzoate Openeye Name: [8-[(dipropylamino)methyl]-4-oxo-2-(trifluoromethyl)-3-(2,3,5-trimethylphenoxy)chromen-7-yl] 4-methylbenzoate CAS Name: 4-methylbenzoic acid [8-[(dipropylamino)methyl]-4-oxo-2-(trifluoromethyl)-3-(2,3,5-trimethylphenoxy)-1-benzopyran-7-yl] ester IUPAC Name: [8-[(dipropylamino)methyl]-4-oxo-2-(trifluoromethyl)-3-(2,3,5-trimethylphenoxy)chromen-7-yl] 4-methylbenzoate Traditional Name: 4-methylbenzoic acid [8-[(dipropylamino)methyl]-4-keto-2-(trifluoromethyl)-3-(2,3,5-trimethylphenoxy)chromen-7-yl] ester Formula: C34H36F3NO5 MolecularWeight: 595.64855

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)CC1=C(C=CC2=C1OC(=C(C2=O)OC3=CC(=CC(=C3C)C)C)C(F)(F)F)OC(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CCCN(CCC)CC1=C(C=CC2=C1OC(=C(C2=O)OC3=CC(=CC(=C3C)C)C)C(F)(F)F)OC(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C34H36F3NO5/c1-7-15-38(16-8-2)19-26-27(42-33(40)24-11-9-20(3)10-12-24)14-13-25-29(39)31(32(34(35,36)37)43-30(25)26)41-28-18-21(4)17-22(5)23(28)6/h9-14,17-18H,7-8,15-16,19H2,1-6H3