5-[[2-[2-(4-fluorophenyl)ethyl]-3-(1-methylimidazol-2-yl)-2H-chromen-6-yl]oxy]-2,2-dimethyl-pentanoate

Systemtic Name: 5-[[2-[2-(4-fluorophenyl)ethyl]-3-(1-methylimidazol-2-yl)-2H-chromen-6-yl]oxy]-2,2-dimethyl-pentanoate Openeye Name: 5-[[2-[2-(4-fluorophenyl)ethyl]-3-(1-methylimidazol-2-yl)-2H-chromen-6-yl]oxy]-2,2-dimethyl-pentanoate CAS Name: 5-[[2-[2-(4-fluorophenyl)ethyl]-3-(1-methyl-2-imidazolyl)-2H-1-benzopyran-6-yl]oxy]-2,2-dimethylpentanoate IUPAC Name: 5-[[2-[2-(4-fluorophenyl)ethyl]-3-(1-methylimidazol-2-yl)-2H-chromen-6-yl]oxy]-2,2-dimethylpentanoate Traditional Name: 5-[[2-[2-(4-fluorophenyl)ethyl]-3-(1-methylimidazol-2-yl)-2H-chromen-6-yl]oxy]-2,2-dimethyl-valerate Formula: C28H30FN2O4- MolecularWeight: 477.547203

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCCOC1=CC2=C(C=C1)OC(C(=C2)C3=NC=CN3C)CCC4=CC=C(C=C4)F)C(=O)[O-]

Isomeric SMILES

CC(C)(CCCOC1=CC2=C(C=C1)OC(C(=C2)C3=NC=CN3C)CCC4=CC=C(C=C4)F)C(=O)[O-]

InChI

InChI=1S/C28H31FN2O4/c1-28(2,27(32)33)13-4-16-34-22-10-12-24-20(17-22)18-23(26-30-14-15-31(26)3)25(35-24)11-7-19-5-8-21(29)9-6-19/h5-6,8-10,12,14-15,17-18,25H,4,7,11,13,16H2,1-3H3,(H,32,33)/p-1