(E)-7-[4-(2-methoxyphenyl)-2,2-dimethyl-1,3-dioxan-5-yl]hept-5-enoic acid

Systemtic Name: (E)-7-[4-(2-methoxyphenyl)-2,2-dimethyl-1,3-dioxan-5-yl]hept-5-enoic acid Openeye Name: (E)-7-[4-(2-methoxyphenyl)-2,2-dimethyl-1,3-dioxan-5-yl]hept-5-enoic acid CAS Name: (E)-7-[4-(2-methoxyphenyl)-2,2-dimethyl-1,3-dioxan-5-yl]-5-heptenoic acid IUPAC Name: (E)-7-[4-(2-methoxyphenyl)-2,2-dimethyl-1,3-dioxan-5-yl]hept-5-enoic acid Traditional Name: (E)-7-[4-(2-methoxyphenyl)-2,2-dimethyl-1,3-dioxan-5-yl]hept-5-enoic acid Formula: C20H28O5 MolecularWeight: 348.43332

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OCC(C(O1)C2=CC=CC=C2OC)CC=CCCCC(=O)O)C

Isomeric SMILES

CC1(OCC(C(O1)C2=CC=CC=C2OC)C/C=C/CCCC(=O)O)C

InChI

InChI=1S/C20H28O5/c1-20(2)24-14-15(10-6-4-5-7-13-18(21)22)19(25-20)16-11-8-9-12-17(16)23-3/h4,6,8-9,11-12,15,19H,5,7,10,13-14H2,1-3H3,(H,21,22)/b6-4+