(E)-5-[3,5-ditert-butyl-2-(methoxymethoxy)phenyl]selanyl-3-methyl-pent-2-en-4-ynoic acid

Systemtic Name: (E)-5-[3,5-ditert-butyl-2-(methoxymethoxy)phenyl]selanyl-3-methyl-pent-2-en-4-ynoic acid Openeye Name: (E)-5-[3,5-ditert-butyl-2-(methoxymethoxy)phenyl]selanyl-3-methyl-pent-2-en-4-ynoic acid CAS Name: (E)-5-[[3,5-ditert-butyl-2-(methoxymethoxy)phenyl]seleno]-3-methylpent-2-en-4-ynoic acid IUPAC Name: (E)-5-[3,5-ditert-butyl-2-(methoxymethoxy)phenyl]selanyl-3-methylpent-2-en-4-ynoic acid Traditional Name: (E)-5-[[3,5-ditert-butyl-2-(methoxymethoxy)phenyl]seleno]-3-methyl-pent-2-en-4-ynoic acid Formula: C22H30O4Se MolecularWeight: 437.4312

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)O)C#C[Se]C1=CC(=CC(=C1OCOC)C(C)(C)C)C(C)(C)C

Isomeric SMILES

C/C(=C\C(=O)O)/C#C[Se]C1=CC(=CC(=C1OCOC)C(C)(C)C)C(C)(C)C

InChI

InChI=1S/C22H30O4Se/c1-15(11-19(23)24)9-10-27-18-13-16(21(2,3)4)12-17(22(5,6)7)20(18)26-14-25-8/h11-13H,14H2,1-8H3,(H,23,24)/b15-11+