2-[3-ethynyl-5-(7-hexyl-2,2,4,4-tetramethyl-3H-chromen-6-yl)furan-2-yl]ethanoate

Systemtic Name: 2-[3-ethynyl-5-(7-hexyl-2,2,4,4-tetramethyl-3H-chromen-6-yl)furan-2-yl]ethanoate Openeye Name: 2-[3-ethynyl-5-(7-hexyl-2,2,4,4-tetramethyl-chroman-6-yl)-2-furyl]acetate CAS Name: 2-[3-ethynyl-5-(7-hexyl-2,2,4,4-tetramethyl-3,4-dihydro-2H-1-benzopyran-6-yl)-2-furanyl]acetate IUPAC Name: 2-[3-ethynyl-5-(7-hexyl-2,2,4,4-tetramethyl-3H-chromen-6-yl)furan-2-yl]acetate Traditional Name: 2-[3-ethynyl-5-(7-hexyl-2,2,4,4-tetramethyl-chroman-6-yl)-2-furyl]acetate Formula: C27H33O4- MolecularWeight: 421.54852

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC2=C(C=C1C3=CC(=C(O3)CC(=O)[O-])C#C)C(CC(O2)(C)C)(C)C

Isomeric SMILES

CCCCCCC1=CC2=C(C=C1C3=CC(=C(O3)CC(=O)[O-])C#C)C(CC(O2)(C)C)(C)C

InChI

InChI=1S/C27H34O4/c1-7-9-10-11-12-19-14-24-21(26(3,4)17-27(5,6)31-24)15-20(19)23-13-18(8-2)22(30-23)16-25(28)29/h2,13-15H,7,9-12,16-17H2,1,3-6H3,(H,28,29)/p-1