methyl 5-oxidanylidene-5-[2-[(1E,3E)-5-oxidanylidenetrideca-1,3-dienyl]phenyl]pentanoate

Systemtic Name: methyl 5-oxidanylidene-5-[2-[(1E,3E)-5-oxidanylidenetrideca-1,3-dienyl]phenyl]pentanoate Openeye Name: methyl 5-oxo-5-[2-[(1E,3E)-5-oxotrideca-1,3-dienyl]phenyl]pentanoate CAS Name: 5-oxo-5-[2-[(1E,3E)-5-oxotrideca-1,3-dienyl]phenyl]pentanoic acid methyl ester IUPAC Name: methyl 5-oxo-5-[2-[(1E,3E)-5-oxotrideca-1,3-dienyl]phenyl]pentanoate Traditional Name: 5-keto-5-[2-[(1E,3E)-5-ketotrideca-1,3-dienyl]phenyl]valeric acid methyl ester Formula: C25H34O4 MolecularWeight: 398.53506

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(=O)C=CC=CC1=CC=CC=C1C(=O)CCCC(=O)OC

Isomeric SMILES

CCCCCCCCC(=O)/C=C/C=C/C1=CC=CC=C1C(=O)CCCC(=O)OC

InChI

InChI=1S/C25H34O4/c1-3-4-5-6-7-8-16-22(26)17-11-9-14-21-15-10-12-18-23(21)24(27)19-13-20-25(28)29-2/h9-12,14-15,17-18H,3-8,13,16,19-20H2,1-2H3/b14-9+,17-11+