1-[3-[[3-(1-methylimidazol-2-yl)-2-phenethyl-2H-chromen-6-yl]oxy]propyl]cyclopentane-1-carboxylic acid

Systemtic Name: 1-[3-[[3-(1-methylimidazol-2-yl)-2-phenethyl-2H-chromen-6-yl]oxy]propyl]cyclopentane-1-carboxylic acid Openeye Name: 1-[3-[[3-(1-methylimidazol-2-yl)-2-phenethyl-2H-chromen-6-yl]oxy]propyl]cyclopentanecarboxylic acid CAS Name: 1-[3-[[3-(1-methyl-2-imidazolyl)-2-phenethyl-2H-1-benzopyran-6-yl]oxy]propyl]-1-cyclopentanecarboxylic acid IUPAC Name: 1-[3-[[3-(1-methylimidazol-2-yl)-2-phenethyl-2H-chromen-6-yl]oxy]propyl]cyclopentane-1-carboxylic acid Traditional Name: 1-[3-[[3-(1-methylimidazol-2-yl)-2-phenethyl-2H-chromen-6-yl]oxy]propyl]cyclopentanecarboxylic acid Formula: C30H34N2O4 MolecularWeight: 486.60196

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1C2=CC3=C(C=CC(=C3)OCCCC4(CCCC4)C(=O)O)OC2CCC5=CC=CC=C5

Isomeric SMILES

CN1C=CN=C1C2=CC3=C(C=CC(=C3)OCCCC4(CCCC4)C(=O)O)OC2CCC5=CC=CC=C5

InChI

InChI=1S/C30H34N2O4/c1-32-18-17-31-28(32)25-21-23-20-24(35-19-7-16-30(29(33)34)14-5-6-15-30)11-13-26(23)36-27(25)12-10-22-8-3-2-4-9-22/h2-4,8-9,11,13,17-18,20-21,27H,5-7,10,12,14-16,19H2,1H3,(H,33,34)