4-[3-[3-(oxan-2-yloxy)propyl]phenoxy]butyl 3-oxidanylidenebutanoate

Systemtic Name: 4-[3-[3-(oxan-2-yloxy)propyl]phenoxy]butyl 3-oxidanylidenebutanoate Openeye Name: 4-[3-(3-tetrahydropyran-2-yloxypropyl)phenoxy]butyl 3-oxobutanoate CAS Name: 3-oxobutanoic acid 4-[3-[3-(2-oxanyloxy)propyl]phenoxy]butyl ester IUPAC Name: 4-[3-[3-(oxan-2-yloxy)propyl]phenoxy]butyl 3-oxobutanoate Traditional Name: 3-ketobutyric acid 4-[3-(3-tetrahydropyran-2-yloxypropyl)phenoxy]butyl ester Formula: C22H32O6 MolecularWeight: 392.48588

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC(=O)OCCCCOC1=CC=CC(=C1)CCCOC2CCCCO2

Isomeric SMILES

CC(=O)CC(=O)OCCCCOC1=CC=CC(=C1)CCCOC2CCCCO2

InChI

InChI=1S/C22H32O6/c1-18(23)16-21(24)26-13-5-4-12-25-20-10-6-8-19(17-20)9-7-15-28-22-11-2-3-14-27-22/h6,8,10,17,22H,2-5,7,9,11-16H2,1H3