(E)-4-[3-(4-phenoxybutoxy)-2-phenyl-oxan-2-yl]oxyhept-5-enoate

Systemtic Name: (E)-4-[3-(4-phenoxybutoxy)-2-phenyl-oxan-2-yl]oxyhept-5-enoate Openeye Name: (E)-4-[3-(4-phenoxybutoxy)-2-phenyl-tetrahydropyran-2-yl]oxyhept-5-enoate CAS Name: (E)-4-[[3-(4-phenoxybutoxy)-2-phenyl-2-oxanyl]oxy]-5-heptenoate IUPAC Name: (E)-4-[3-(4-phenoxybutoxy)-2-phenyloxan-2-yl]oxyhept-5-enoate Traditional Name: (E)-4-[3-(4-phenoxybutoxy)-2-phenyl-tetrahydropyran-2-yl]oxyhept-5-enoate Formula: C28H35O6- MolecularWeight: 467.5739

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC(CCC(=O)[O-])OC1(C(CCCO1)OCCCCOC2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

C/C=C/C(CCC(=O)[O-])OC1(C(CCCO1)OCCCCOC2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C28H36O6/c1-2-12-25(18-19-27(29)30)34-28(23-13-5-3-6-14-23)26(17-11-22-33-28)32-21-10-9-20-31-24-15-7-4-8-16-24/h2-8,12-16,25-26H,9-11,17-22H2,1H3,(H,29,30)/p-1/b12-2+