(E)-6-(2,2-dimethyl-4-pyridin-4-yl-1,3-dioxan-5-yl)hex-4-enoic acid

Systemtic Name: (E)-6-(2,2-dimethyl-4-pyridin-4-yl-1,3-dioxan-5-yl)hex-4-enoic acid Openeye Name: (E)-6-[2,2-dimethyl-4-(4-pyridyl)-1,3-dioxan-5-yl]hex-4-enoic acid CAS Name: (E)-6-(2,2-dimethyl-4-pyridin-4-yl-1,3-dioxan-5-yl)-4-hexenoic acid IUPAC Name: (E)-6-(2,2-dimethyl-4-pyridin-4-yl-1,3-dioxan-5-yl)hex-4-enoic acid Traditional Name: (E)-6-[2,2-dimethyl-4-(4-pyridyl)-1,3-dioxan-5-yl]hex-4-enoic acid Formula: C17H23NO4 MolecularWeight: 305.36882

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OCC(C(O1)C2=CC=NC=C2)CC=CCCC(=O)O)C

Isomeric SMILES

CC1(OCC(C(O1)C2=CC=NC=C2)C/C=C/CCC(=O)O)C

InChI

InChI=1S/C17H23NO4/c1-17(2)21-12-14(6-4-3-5-7-15(19)20)16(22-17)13-8-10-18-11-9-13/h3-4,8-11,14,16H,5-7,12H2,1-2H3,(H,19,20)/b4-3+