(Z)-6-[(2S,4S,5R)-2-[4-[[4-[(E)-7-ethoxy-7-oxidanylidene-1-pyridin-3-yl-hept-1-enyl]phenoxy]methyl]phenyl]-4-(2-hydroxyphenyl)-1,3-dioxan-5-yl]hex-4-enoic acid

Systemtic Name: (Z)-6-[(2S,4S,5R)-2-[4-[[4-[(E)-7-ethoxy-7-oxidanylidene-1-pyridin-3-yl-hept-1-enyl]phenoxy]methyl]phenyl]-4-(2-hydroxyphenyl)-1,3-dioxan-5-yl]hex-4-enoic acid Openeye Name: (Z)-6-[(2S,4S,5R)-2-[4-[[4-[(E)-7-ethoxy-7-oxo-1-(3-pyridyl)hept-1-enyl]phenoxy]methyl]phenyl]-4-(2-hydroxyphenyl)-1,3-dioxan-5-yl]hex-4-enoic acid CAS Name: (Z)-6-[(2S,4S,5R)-2-[4-[[4-[(E)-7-ethoxy-7-oxo-1-(3-pyridinyl)hept-1-enyl]phenoxy]methyl]phenyl]-4-(2-hydroxyphenyl)-1,3-dioxan-5-yl]-4-hexenoic acid IUPAC Name: (Z)-6-[(2S,4S,5R)-2-[4-[[4-[(E)-7-ethoxy-7-oxo-1-pyridin-3-ylhept-1-enyl]phenoxy]methyl]phenyl]-4-(2-hydroxyphenyl)-1,3-dioxan-5-yl]hex-4-enoic acid Traditional Name: (Z)-6-[(2S,4S,5R)-2-[4-[[4-[(E)-7-ethoxy-7-keto-1-(3-pyridyl)hept-1-enyl]phenoxy]methyl]phenyl]-4-(2-hydroxyphenyl)-1,3-dioxan-5-yl]hex-4-enoic acid Formula: C43H47NO8 MolecularWeight: 705.83518

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCCC=C(C1=CC=C(C=C1)OCC2=CC=C(C=C2)C3OCC(C(O3)C4=CC=CC=C4O)CC=CCCC(=O)O)C5=CN=CC=C5

Isomeric SMILES

CCOC(=O)CCCC/C=C(\C1=CC=C(C=C1)OCC2=CC=C(C=C2)[C@H]3OC[C@H]([C@H](O3)C4=CC=CC=C4O)C/C=C\CCC(=O)O)/C5=CN=CC=C5

InChI

InChI=1S/C43H47NO8/c1-2-49-41(48)18-8-4-6-14-37(34-13-11-27-44-28-34)32-23-25-36(26-24-32)50-29-31-19-21-33(22-20-31)43-51-30-35(12-5-3-7-17-40(46)47)42(52-43)38-15-9-10-16-39(38)45/h3,5,9-11,13-16,19-28,35,42-43,45H,2,4,6-8,12,17-18,29-30H2,1H3,(H,46,47)/b5-3-,37-14+/t35-,42+,43+/m1/s1