6-[(4-oxidanylidene-8-propyl-2,3-dihydrochromen-7-yl)oxy]hexyl 5-phenylpentanoate

Systemtic Name: 6-[(4-oxidanylidene-8-propyl-2,3-dihydrochromen-7-yl)oxy]hexyl 5-phenylpentanoate Openeye Name: 6-(4-oxo-8-propyl-chroman-7-yl)oxyhexyl 5-phenylpentanoate CAS Name: 5-phenylpentanoic acid 6-[(4-oxo-8-propyl-3,4-dihydro-2H-1-benzopyran-7-yl)oxy]hexyl ester IUPAC Name: 6-[(4-oxo-8-propyl-2,3-dihydrochromen-7-yl)oxy]hexyl 5-phenylpentanoate Traditional Name: 5-phenylvaleric acid 6-(4-keto-8-propyl-chroman-7-yl)oxyhexyl ester Formula: C29H38O5 MolecularWeight: 466.60902

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC2=C1OCCC2=O)OCCCCCCOC(=O)CCCCC3=CC=CC=C3

Isomeric SMILES

CCCC1=C(C=CC2=C1OCCC2=O)OCCCCCCOC(=O)CCCCC3=CC=CC=C3

InChI

InChI=1S/C29H38O5/c1-2-12-25-27(18-17-24-26(30)19-22-34-29(24)25)32-20-10-3-4-11-21-33-28(31)16-9-8-15-23-13-6-5-7-14-23/h5-7,13-14,17-18H,2-4,8-12,15-16,19-22H2,1H3