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

Systemtic Name: ethyl 2,2-dimethyl-5-[[3-(1-methylimidazol-2-yl)-2-phenethyl-2H-chromen-6-yl]oxy]pentanoate Openeye Name: ethyl 2,2-dimethyl-5-[[3-(1-methylimidazol-2-yl)-2-phenethyl-2H-chromen-6-yl]oxy]pentanoate CAS Name: 2,2-dimethyl-5-[[3-(1-methyl-2-imidazolyl)-2-phenethyl-2H-1-benzopyran-6-yl]oxy]pentanoic acid ethyl ester IUPAC Name: ethyl 2,2-dimethyl-5-[[3-(1-methylimidazol-2-yl)-2-phenethyl-2H-chromen-6-yl]oxy]pentanoate Traditional Name: 2,2-dimethyl-5-[[3-(1-methylimidazol-2-yl)-2-phenethyl-2H-chromen-6-yl]oxy]valeric acid ethyl ester Formula: C30H36N2O4 MolecularWeight: 488.61784

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)(C)CCCOC1=CC2=C(C=C1)OC(C(=C2)C3=NC=CN3C)CCC4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C(C)(C)CCCOC1=CC2=C(C=C1)OC(C(=C2)C3=NC=CN3C)CCC4=CC=CC=C4

InChI

InChI=1S/C30H36N2O4/c1-5-34-29(33)30(2,3)16-9-19-35-24-13-15-26-23(20-24)21-25(28-31-17-18-32(28)4)27(36-26)14-12-22-10-7-6-8-11-22/h6-8,10-11,13,15,17-18,20-21,27H,5,9,12,14,16,19H2,1-4H3