2-[3-[4-[(2-tert-butyl-1,3-dioxolan-2-yl)methoxy]-3-methyl-phenyl]pentan-3-yl]-1-benzofuran-5-carboxylic acid

Systemtic Name: 2-[3-[4-[(2-tert-butyl-1,3-dioxolan-2-yl)methoxy]-3-methyl-phenyl]pentan-3-yl]-1-benzofuran-5-carboxylic acid Openeye Name: 2-[1-[4-[(2-tert-butyl-1,3-dioxolan-2-yl)methoxy]-3-methyl-phenyl]-1-ethyl-propyl]benzofuran-5-carboxylic acid CAS Name: 2-[3-[4-[(2-tert-butyl-1,3-dioxolan-2-yl)methoxy]-3-methylphenyl]pentan-3-yl]-5-benzofurancarboxylic acid IUPAC Name: 2-[3-[4-[(2-tert-butyl-1,3-dioxolan-2-yl)methoxy]-3-methylphenyl]pentan-3-yl]-1-benzofuran-5-carboxylic acid Traditional Name: 2-[1-[4-[(2-tert-butyl-1,3-dioxolan-2-yl)methoxy]-3-methyl-phenyl]-1-ethyl-propyl]benzofuran-5-carboxylic acid Formula: C29H36O6 MolecularWeight: 480.59254

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C1=CC(=C(C=C1)OCC2(OCCO2)C(C)(C)C)C)C3=CC4=C(O3)C=CC(=C4)C(=O)O

Isomeric SMILES

CCC(CC)(C1=CC(=C(C=C1)OCC2(OCCO2)C(C)(C)C)C)C3=CC4=C(O3)C=CC(=C4)C(=O)O

InChI

InChI=1S/C29H36O6/c1-7-28(8-2,25-17-21-16-20(26(30)31)9-11-24(21)35-25)22-10-12-23(19(3)15-22)32-18-29(27(4,5)6)33-13-14-34-29/h9-12,15-17H,7-8,13-14,18H2,1-6H3,(H,30,31)