2-[[5-[3-[4-(3,3-dimethyl-2-oxidanyl-butoxy)-3-methyl-phenyl]pentan-3-yl]-3-methyl-1-benzofuran-2-yl]carbonylamino]ethanoic acid

Systemtic Name: 2-[[5-[3-[4-(3,3-dimethyl-2-oxidanyl-butoxy)-3-methyl-phenyl]pentan-3-yl]-3-methyl-1-benzofuran-2-yl]carbonylamino]ethanoic acid Openeye Name: 2-[[5-[1-ethyl-1-[4-(2-hydroxy-3,3-dimethyl-butoxy)-3-methyl-phenyl]propyl]-3-methyl-benzofuran-2-carbonyl]amino]acetic acid CAS Name: 2-[[[5-[3-[4-(2-hydroxy-3,3-dimethylbutoxy)-3-methylphenyl]pentan-3-yl]-3-methyl-2-benzofuranyl]-oxomethyl]amino]acetic acid IUPAC Name: 2-[[5-[3-[4-(2-hydroxy-3,3-dimethylbutoxy)-3-methylphenyl]pentan-3-yl]-3-methyl-1-benzofuran-2-carbonyl]amino]acetic acid Traditional Name: 2-[[5-[1-ethyl-1-[4-(2-hydroxy-3,3-dimethyl-butoxy)-3-methyl-phenyl]propyl]-3-methyl-benzofuran-2-carbonyl]amino]acetic acid Formula: C30H39NO6 MolecularWeight: 509.63376

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C1=CC(=C(C=C1)OCC(C(C)(C)C)O)C)C2=CC3=C(C=C2)OC(=C3C)C(=O)NCC(=O)O

Isomeric SMILES

CCC(CC)(C1=CC(=C(C=C1)OCC(C(C)(C)C)O)C)C2=CC3=C(C=C2)OC(=C3C)C(=O)NCC(=O)O

InChI

InChI=1S/C30H39NO6/c1-8-30(9-2,20-10-12-23(18(3)14-20)36-17-25(32)29(5,6)7)21-11-13-24-22(15-21)19(4)27(37-24)28(35)31-16-26(33)34/h10-15,25,32H,8-9,16-17H2,1-7H3,(H,31,35)(H,33,34)