(Z)-7-[(4S,5S)-2,2-dimethyl-4-phenyl-1,3-dioxan-5-yl]hept-5-enoic acid

Systemtic Name: (Z)-7-[(4S,5S)-2,2-dimethyl-4-phenyl-1,3-dioxan-5-yl]hept-5-enoic acid Openeye Name: (Z)-7-[(4S,5S)-2,2-dimethyl-4-phenyl-1,3-dioxan-5-yl]hept-5-enoic acid CAS Name: (Z)-7-[(4S,5S)-2,2-dimethyl-4-phenyl-1,3-dioxan-5-yl]-5-heptenoic acid IUPAC Name: (Z)-7-[(4S,5S)-2,2-dimethyl-4-phenyl-1,3-dioxan-5-yl]hept-5-enoic acid Traditional Name: (Z)-7-[(4S,5S)-2,2-dimethyl-4-phenyl-1,3-dioxan-5-yl]hept-5-enoic acid Formula: C19H26O4 MolecularWeight: 318.40734

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1(OC[C@@H]([C@H](O1)C2=CC=CC=C2)C/C=C\CCCC(=O)O)C

InChI

InChI=1S/C19H26O4/c1-19(2)22-14-16(12-6-3-4-9-13-17(20)21)18(23-19)15-10-7-5-8-11-15/h3,5-8,10-11,16,18H,4,9,12-14H2,1-2H3,(H,20,21)/b6-3-/t16-,18+/m0/s1