(E)-7-(2,2-diethyl-4-phenyl-1,3-dioxan-5-yl)hept-5-enoic acid

Systemtic Name: (E)-7-(2,2-diethyl-4-phenyl-1,3-dioxan-5-yl)hept-5-enoic acid Openeye Name: (E)-7-(2,2-diethyl-4-phenyl-1,3-dioxan-5-yl)hept-5-enoic acid CAS Name: (E)-7-(2,2-diethyl-4-phenyl-1,3-dioxan-5-yl)-5-heptenoic acid IUPAC Name: (E)-7-(2,2-diethyl-4-phenyl-1,3-dioxan-5-yl)hept-5-enoic acid Traditional Name: (E)-7-(2,2-diethyl-4-phenyl-1,3-dioxan-5-yl)hept-5-enoic acid Formula: C21H30O4 MolecularWeight: 346.4605

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(OCC(C(O1)C2=CC=CC=C2)CC=CCCCC(=O)O)CC

Isomeric SMILES

CCC1(OCC(C(O1)C2=CC=CC=C2)C/C=C/CCCC(=O)O)CC

InChI

InChI=1S/C21H30O4/c1-3-21(4-2)24-16-18(14-8-5-6-11-15-19(22)23)20(25-21)17-12-9-7-10-13-17/h5,7-10,12-13,18,20H,3-4,6,11,14-16H2,1-2H3,(H,22,23)/b8-5+