1-[3-(3-methylbut-2-enoyl)-4-oxidanyl-phenyl]ethyl pentadecanoate

Systemtic Name: 1-[3-(3-methylbut-2-enoyl)-4-oxidanyl-phenyl]ethyl pentadecanoate Openeye Name: 1-[4-hydroxy-3-(3-methylbut-2-enoyl)phenyl]ethyl pentadecanoate CAS Name: pentadecanoic acid 1-[4-hydroxy-3-(3-methyl-1-oxobut-2-enyl)phenyl]ethyl ester IUPAC Name: 1-[4-hydroxy-3-(3-methylbut-2-enoyl)phenyl]ethyl pentadecanoate Traditional Name: pentadecanoic acid 1-[4-hydroxy-3-(3-methylbut-2-enoyl)phenyl]ethyl ester Formula: C28H44O4 MolecularWeight: 444.64656

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCC(=O)OC(C)C1=CC(=C(C=C1)O)C(=O)C=C(C)C

Isomeric SMILES

CCCCCCCCCCCCCCC(=O)OC(C)C1=CC(=C(C=C1)O)C(=O)C=C(C)C

InChI

InChI=1S/C28H44O4/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-28(31)32-23(4)24-18-19-26(29)25(21-24)27(30)20-22(2)3/h18-21,23,29H,5-17H2,1-4H3