oxan-2-yl 4-[3-(3-acetyloxy-4-ethanoyl-2-propyl-phenoxy)propoxy]-3-bromanyl-benzoate

Systemtic Name: oxan-2-yl 4-[3-(3-acetyloxy-4-ethanoyl-2-propyl-phenoxy)propoxy]-3-bromanyl-benzoate Openeye Name: tetrahydropyran-2-yl 4-[3-(3-acetoxy-4-acetyl-2-propyl-phenoxy)propoxy]-3-bromo-benzoate CAS Name: 4-[3-(4-acetyl-3-acetyloxy-2-propylphenoxy)propoxy]-3-bromobenzoic acid 2-oxanyl ester IUPAC Name: oxan-2-yl 4-[3-(4-acetyl-3-acetyloxy-2-propylphenoxy)propoxy]-3-bromobenzoate Traditional Name: 4-[3-(3-acetoxy-4-acetyl-2-propyl-phenoxy)propoxy]-3-bromo-benzoic acid tetrahydropyran-2-yl ester Formula: C28H33BrO8 MolecularWeight: 577.46082

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1OC(=O)C)C(=O)C)OCCCOC2=C(C=C(C=C2)C(=O)OC3CCCCO3)Br

Isomeric SMILES

CCCC1=C(C=CC(=C1OC(=O)C)C(=O)C)OCCCOC2=C(C=C(C=C2)C(=O)OC3CCCCO3)Br

InChI

InChI=1S/C28H33BrO8/c1-4-8-22-24(13-11-21(18(2)30)27(22)36-19(3)31)33-15-7-16-34-25-12-10-20(17-23(25)29)28(32)37-26-9-5-6-14-35-26/h10-13,17,26H,4-9,14-16H2,1-3H3