[3,4,5-triacetyloxy-6-[4-(4-cyanophenyl)carbonylphenoxy]oxan-2-yl]methyl ethanoate

Systemtic Name: [3,4,5-triacetyloxy-6-[4-(4-cyanophenyl)carbonylphenoxy]oxan-2-yl]methyl ethanoate Openeye Name: [3,4,5-triacetoxy-6-[4-(4-cyanobenzoyl)phenoxy]tetrahydropyran-2-yl]methyl acetate CAS Name: acetic acid [3,4,5-triacetyloxy-6-[4-[(4-cyanophenyl)-oxomethyl]phenoxy]-2-oxanyl]methyl ester IUPAC Name: [3,4,5-triacetyloxy-6-[4-(4-cyanobenzoyl)phenoxy]oxan-2-yl]methyl acetate Traditional Name: acetic acid [3,4,5-triacetoxy-6-[4-(4-cyanobenzoyl)phenoxy]tetrahydropyran-2-yl]methyl ester Formula: C28H27NO11 MolecularWeight: 553.51408

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1C(C(C(C(O1)OC2=CC=C(C=C2)C(=O)C3=CC=C(C=C3)C#N)OC(=O)C)OC(=O)C)OC(=O)C

Isomeric SMILES

CC(=O)OCC1C(C(C(C(O1)OC2=CC=C(C=C2)C(=O)C3=CC=C(C=C3)C#N)OC(=O)C)OC(=O)C)OC(=O)C

InChI

InChI=1S/C28H27NO11/c1-15(30)35-14-23-25(36-16(2)31)26(37-17(3)32)27(38-18(4)33)28(40-23)39-22-11-9-21(10-12-22)24(34)20-7-5-19(13-29)6-8-20/h5-12,23,25-28H,14H2,1-4H3