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

Systemtic Name: 2,2-dimethyl-5-[[3-(1-methylimidazol-2-yl)-2-phenethyl-2H-chromen-6-yl]oxy]pentanoic acid Openeye Name: 2,2-dimethyl-5-[[3-(1-methylimidazol-2-yl)-2-phenethyl-2H-chromen-6-yl]oxy]pentanoic acid CAS Name: 2,2-dimethyl-5-[[3-(1-methyl-2-imidazolyl)-2-phenethyl-2H-1-benzopyran-6-yl]oxy]pentanoic acid IUPAC Name: 2,2-dimethyl-5-[[3-(1-methylimidazol-2-yl)-2-phenethyl-2H-chromen-6-yl]oxy]pentanoic acid Traditional Name: 2,2-dimethyl-5-[[3-(1-methylimidazol-2-yl)-2-phenethyl-2H-chromen-6-yl]oxy]valeric acid Formula: C28H32N2O4 MolecularWeight: 460.56468

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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=CC=C4)C(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C28H32N2O4/c1-28(2,27(31)32)14-7-17-33-22-11-13-24-21(18-22)19-23(26-29-15-16-30(26)3)25(34-24)12-10-20-8-5-4-6-9-20/h4-6,8-9,11,13,15-16,18-19,25H,7,10,12,14,17H2,1-3H3,(H,31,32)