1-phenoxyethyl 2-[4-(oxan-2-yloxy)butyl]-3-oxidanylidene-hexanoate

Systemtic Name: 1-phenoxyethyl 2-[4-(oxan-2-yloxy)butyl]-3-oxidanylidene-hexanoate Openeye Name: 1-phenoxyethyl 3-oxo-2-(4-tetrahydropyran-2-yloxybutyl)hexanoate CAS Name: 2-[4-(2-oxanyloxy)butyl]-3-oxohexanoic acid 1-phenoxyethyl ester IUPAC Name: 1-phenoxyethyl 2-[4-(oxan-2-yloxy)butyl]-3-oxohexanoate Traditional Name: 3-keto-2-(4-tetrahydropyran-2-yloxybutyl)hexanoic acid 1-phenoxyethyl ester Formula: C23H34O6 MolecularWeight: 406.51246

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C(CCCCOC1CCCCO1)C(=O)OC(C)OC2=CC=CC=C2

Isomeric SMILES

CCCC(=O)C(CCCCOC1CCCCO1)C(=O)OC(C)OC2=CC=CC=C2

InChI

InChI=1S/C23H34O6/c1-3-11-21(24)20(14-7-9-16-26-22-15-8-10-17-27-22)23(25)29-18(2)28-19-12-5-4-6-13-19/h4-6,12-13,18,20,22H,3,7-11,14-17H2,1-2H3