butyl 2-[4-[4-(oxan-2-yloxy)butyl]phenyl]sulfanyl-3-oxidanylidene-butanoate

Systemtic Name: butyl 2-[4-[4-(oxan-2-yloxy)butyl]phenyl]sulfanyl-3-oxidanylidene-butanoate Openeye Name: butyl 3-oxo-2-[4-(4-tetrahydropyran-2-yloxybutyl)phenyl]sulfanyl-butanoate CAS Name: 2-[[4-[4-(2-oxanyloxy)butyl]phenyl]thio]-3-oxobutanoic acid butyl ester IUPAC Name: butyl 2-[4-[4-(oxan-2-yloxy)butyl]phenyl]sulfanyl-3-oxobutanoate Traditional Name: 3-keto-2-[[4-(4-tetrahydropyran-2-yloxybutyl)phenyl]thio]butyric acid butyl ester Formula: C23H34O5S MolecularWeight: 422.57806

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C(C(=O)C)SC1=CC=C(C=C1)CCCCOC2CCCCO2

Isomeric SMILES

CCCCOC(=O)C(C(=O)C)SC1=CC=C(C=C1)CCCCOC2CCCCO2

InChI

InChI=1S/C23H34O5S/c1-3-4-15-28-23(25)22(18(2)24)29-20-13-11-19(12-14-20)9-5-7-16-26-21-10-6-8-17-27-21/h11-14,21-22H,3-10,15-17H2,1-2H3