(Z)-6-[(4S,5R)-2,2-dimethyl-4-thiophen-2-yl-1,3-dioxan-5-yl]hex-4-enoic acid

Systemtic Name: (Z)-6-[(4S,5R)-2,2-dimethyl-4-thiophen-2-yl-1,3-dioxan-5-yl]hex-4-enoic acid Openeye Name: (Z)-6-[(4S,5R)-2,2-dimethyl-4-(2-thienyl)-1,3-dioxan-5-yl]hex-4-enoic acid CAS Name: (Z)-6-[(4S,5R)-2,2-dimethyl-4-thiophen-2-yl-1,3-dioxan-5-yl]-4-hexenoic acid IUPAC Name: (Z)-6-[(4S,5R)-2,2-dimethyl-4-thiophen-2-yl-1,3-dioxan-5-yl]hex-4-enoic acid Traditional Name: (Z)-6-[(4S,5R)-2,2-dimethyl-4-(2-thienyl)-1,3-dioxan-5-yl]hex-4-enoic acid Formula: C16H22O4S MolecularWeight: 310.40848

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OCC(C(O1)C2=CC=CS2)CC=CCCC(=O)O)C

Isomeric SMILES

CC1(OC[C@H]([C@H](O1)C2=CC=CS2)C/C=C\CCC(=O)O)C

InChI

InChI=1S/C16H22O4S/c1-16(2)19-11-12(7-4-3-5-9-14(17)18)15(20-16)13-8-6-10-21-13/h3-4,6,8,10,12,15H,5,7,9,11H2,1-2H3,(H,17,18)/b4-3-/t12-,15+/m1/s1