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

Systemtic Name: (E)-7-[4-(2-hydroxyphenyl)-2,2-dimethyl-1,3-dioxan-5-yl]hept-2-enoic acid Openeye Name: (E)-7-[4-(2-hydroxyphenyl)-2,2-dimethyl-1,3-dioxan-5-yl]hept-2-enoic acid CAS Name: (E)-7-[4-(2-hydroxyphenyl)-2,2-dimethyl-1,3-dioxan-5-yl]-2-heptenoic acid IUPAC Name: (E)-7-[4-(2-hydroxyphenyl)-2,2-dimethyl-1,3-dioxan-5-yl]hept-2-enoic acid Traditional Name: (E)-7-[4-(2-hydroxyphenyl)-2,2-dimethyl-1,3-dioxan-5-yl]hept-2-enoic acid Formula: C19H26O5 MolecularWeight: 334.40674

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OCC(C(O1)C2=CC=CC=C2O)CCCCC=CC(=O)O)C

Isomeric SMILES

CC1(OCC(C(O1)C2=CC=CC=C2O)CCCC/C=C/C(=O)O)C

InChI

InChI=1S/C19H26O5/c1-19(2)23-13-14(9-5-3-4-6-12-17(21)22)18(24-19)15-10-7-8-11-16(15)20/h6-8,10-12,14,18,20H,3-5,9,13H2,1-2H3,(H,21,22)/b12-6+