3-[3-[tert-butyl(diphenyl)silyl]-2,2,4-trimethyl-7-pentyl-4H-chromen-3-yl]propanoic acid

Systemtic Name: 3-[3-[tert-butyl(diphenyl)silyl]-2,2,4-trimethyl-7-pentyl-4H-chromen-3-yl]propanoic acid Openeye Name: 3-[3-[tert-butyl(diphenyl)silyl]-2,2,4-trimethyl-7-pentyl-chroman-3-yl]propanoic acid CAS Name: 3-[3-[tert-butyl(diphenyl)silyl]-2,2,4-trimethyl-7-pentyl-3,4-dihydro-2H-1-benzopyran-3-yl]propanoic acid IUPAC Name: 3-[3-[tert-butyl(diphenyl)silyl]-2,2,4-trimethyl-7-pentyl-4H-chromen-3-yl]propanoic acid Traditional Name: 3-[7-amyl-3-[tert-butyl(diphenyl)silyl]-2,2,4-trimethyl-chroman-3-yl]propionic acid Formula: C36H48O3Si MolecularWeight: 556.85002

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC2=C(C=C1)C(C(C(O2)(C)C)(CCC(=O)O)[Si](C3=CC=CC=C3)(C4=CC=CC=C4)C(C)(C)C)C

Isomeric SMILES

CCCCCC1=CC2=C(C=C1)C(C(C(O2)(C)C)(CCC(=O)O)[Si](C3=CC=CC=C3)(C4=CC=CC=C4)C(C)(C)C)C

InChI

InChI=1S/C36H48O3Si/c1-8-9-12-17-28-22-23-31-27(2)36(25-24-33(37)38,35(6,7)39-32(31)26-28)40(34(3,4)5,29-18-13-10-14-19-29)30-20-15-11-16-21-30/h10-11,13-16,18-23,26-27H,8-9,12,17,24-25H2,1-7H3,(H,37,38)