6-[2-methyl-1-(6-oxidanylhexyl)-4-[(E)-3-oxidanyloct-5-enyl]pyrrol-3-yl]hept-6-enoic acid

Systemtic Name: 6-[2-methyl-1-(6-oxidanylhexyl)-4-[(E)-3-oxidanyloct-5-enyl]pyrrol-3-yl]hept-6-enoic acid Openeye Name: 6-[1-(6-hydroxyhexyl)-4-[(E)-3-hydroxyoct-5-enyl]-2-methyl-pyrrol-3-yl]hept-6-enoic acid CAS Name: 6-[1-(6-hydroxyhexyl)-4-[(E)-3-hydroxyoct-5-enyl]-2-methyl-3-pyrrolyl]-6-heptenoic acid IUPAC Name: 6-[1-(6-hydroxyhexyl)-4-[(E)-3-hydroxyoct-5-enyl]-2-methylpyrrol-3-yl]hept-6-enoic acid Traditional Name: 6-[1-(6-hydroxyhexyl)-4-[(E)-3-hydroxyoct-5-enyl]-2-methyl-pyrrol-3-yl]hept-6-enoic acid Formula: C26H43NO4 MolecularWeight: 433.62392

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Descriptors Computed from Structure

Canonical SMILES:

CCC=CCC(CCC1=CN(C(=C1C(=C)CCCCC(=O)O)C)CCCCCCO)O

Isomeric SMILES

CC/C=C/CC(CCC1=CN(C(=C1C(=C)CCCCC(=O)O)C)CCCCCCO)O

InChI

InChI=1S/C26H43NO4/c1-4-5-8-14-24(29)17-16-23-20-27(18-11-6-7-12-19-28)22(3)26(23)21(2)13-9-10-15-25(30)31/h5,8,20,24,28-29H,2,4,6-7,9-19H2,1,3H3,(H,30,31)/b8-5+