(E)-7-[3-[(E)-3-methyl-3-oxidanyl-oct-1-enyl]-2-(nitromethyl)-6,9-dioxaspiro[4.4]nonan-4-yl]hept-5-enoic acid

Systemtic Name: (E)-7-[3-[(E)-3-methyl-3-oxidanyl-oct-1-enyl]-2-(nitromethyl)-6,9-dioxaspiro[4.4]nonan-4-yl]hept-5-enoic acid Openeye Name: (E)-7-[3-[(E)-3-hydroxy-3-methyl-oct-1-enyl]-2-(nitromethyl)-6,9-dioxaspiro[4.4]nonan-4-yl]hept-5-enoic acid CAS Name: (E)-7-[3-[(E)-3-hydroxy-3-methyloct-1-enyl]-2-(nitromethyl)-6,9-dioxaspiro[4.4]nonan-4-yl]-5-heptenoic acid IUPAC Name: (E)-7-[3-[(E)-3-hydroxy-3-methyloct-1-enyl]-2-(nitromethyl)-6,9-dioxaspiro[4.4]nonan-4-yl]hept-5-enoic acid Traditional Name: (E)-7-[3-[(E)-3-hydroxy-3-methyl-oct-1-enyl]-2-(nitromethyl)-6,9-dioxaspiro[4.4]nonan-4-yl]hept-5-enoic acid Formula: C24H39NO7 MolecularWeight: 453.56896

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)(C=CC1C(CC2(C1CC=CCCCC(=O)O)OCCO2)C[N+](=O)[O-])O

Isomeric SMILES

CCCCCC(C)(/C=C/C1C(CC2(C1C/C=C/CCCC(=O)O)OCCO2)C[N+](=O)[O-])O

InChI

InChI=1S/C24H39NO7/c1-3-4-9-13-23(2,28)14-12-20-19(18-25(29)30)17-24(31-15-16-32-24)21(20)10-7-5-6-8-11-22(26)27/h5,7,12,14,19-21,28H,3-4,6,8-11,13,15-18H2,1-2H3,(H,26,27)/b7-5+,14-12+