[(2S,5R)-6,6-diethoxy-5-(4-methoxyphenoxy)hexan-2-yl] (E,5R)-5-oxidanylhex-2-enoate

Systemtic Name: [(2S,5R)-6,6-diethoxy-5-(4-methoxyphenoxy)hexan-2-yl] (E,5R)-5-oxidanylhex-2-enoate Openeye Name: [(1S,4R)-5,5-diethoxy-4-(4-methoxyphenoxy)-1-methyl-pentyl] (E,5R)-5-hydroxyhex-2-enoate CAS Name: (E,5R)-5-hydroxy-2-hexenoic acid [(2S,5R)-6,6-diethoxy-5-(4-methoxyphenoxy)hexan-2-yl] ester IUPAC Name: [(2S,5R)-6,6-diethoxy-5-(4-methoxyphenoxy)hexan-2-yl] (E,5R)-5-hydroxyhex-2-enoate Traditional Name: (E,5R)-5-hydroxyhex-2-enoic acid [(1S,4R)-5,5-diethoxy-4-(4-methoxyphenoxy)-1-methyl-pentyl] ester Formula: C23H36O7 MolecularWeight: 424.52774

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(C(CCC(C)OC(=O)C=CCC(C)O)OC1=CC=C(C=C1)OC)OCC

Isomeric SMILES

CCOC([C@@H](CC[C@H](C)OC(=O)/C=C/C[C@@H](C)O)OC1=CC=C(C=C1)OC)OCC

InChI

InChI=1S/C23H36O7/c1-6-27-23(28-7-2)21(30-20-14-12-19(26-5)13-15-20)16-11-18(4)29-22(25)10-8-9-17(3)24/h8,10,12-15,17-18,21,23-24H,6-7,9,11,16H2,1-5H3/b10-8+/t17-,18+,21-/m1/s1