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

Systemtic Name: ethyl 5-[[2-butyl-3-(1-methylimidazol-2-yl)-2H-chromen-6-yl]oxy]-2,2-dimethyl-pentanoate Openeye Name: ethyl 5-[[2-butyl-3-(1-methylimidazol-2-yl)-2H-chromen-6-yl]oxy]-2,2-dimethyl-pentanoate CAS Name: 5-[[2-butyl-3-(1-methyl-2-imidazolyl)-2H-1-benzopyran-6-yl]oxy]-2,2-dimethylpentanoic acid ethyl ester IUPAC Name: ethyl 5-[[2-butyl-3-(1-methylimidazol-2-yl)-2H-chromen-6-yl]oxy]-2,2-dimethylpentanoate Traditional Name: 5-[[2-butyl-3-(1-methylimidazol-2-yl)-2H-chromen-6-yl]oxy]-2,2-dimethyl-valeric acid ethyl ester Formula: C26H36N2O4 MolecularWeight: 440.57504

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1C(=CC2=C(O1)C=CC(=C2)OCCCC(C)(C)C(=O)OCC)C3=NC=CN3C

Isomeric SMILES

CCCCC1C(=CC2=C(O1)C=CC(=C2)OCCCC(C)(C)C(=O)OCC)C3=NC=CN3C

InChI

InChI=1S/C26H36N2O4/c1-6-8-10-23-21(24-27-14-15-28(24)5)18-19-17-20(11-12-22(19)32-23)31-16-9-13-26(3,4)25(29)30-7-2/h11-12,14-15,17-18,23H,6-10,13,16H2,1-5H3