7-[3-(acetamidomethyl)-2-[(E)-oct-1-enyl]-5-oxidanylidene-cyclopentyl]-2-acetyloxy-heptanoic acid

Systemtic Name: 7-[3-(acetamidomethyl)-2-[(E)-oct-1-enyl]-5-oxidanylidene-cyclopentyl]-2-acetyloxy-heptanoic acid Openeye Name: 7-[3-(acetamidomethyl)-2-[(E)-oct-1-enyl]-5-oxo-cyclopentyl]-2-acetoxy-heptanoic acid CAS Name: 7-[3-(acetamidomethyl)-2-[(E)-oct-1-enyl]-5-oxocyclopentyl]-2-acetyloxyheptanoic acid IUPAC Name: 7-[3-(acetamidomethyl)-2-[(E)-oct-1-enyl]-5-oxocyclopentyl]-2-acetyloxyheptanoic acid Traditional Name: 7-[3-(acetamidomethyl)-5-keto-2-[(E)-oct-1-enyl]cyclopentyl]-2-acetoxy-enanthic acid Formula: C25H41NO6 MolecularWeight: 451.59614

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC=CC1C(CC(=O)C1CCCCCC(C(=O)O)OC(=O)C)CNC(=O)C

Isomeric SMILES

CCCCCC/C=C/C1C(CC(=O)C1CCCCCC(C(=O)O)OC(=O)C)CNC(=O)C

InChI

InChI=1S/C25H41NO6/c1-4-5-6-7-8-10-13-21-20(17-26-18(2)27)16-23(29)22(21)14-11-9-12-15-24(25(30)31)32-19(3)28/h10,13,20-22,24H,4-9,11-12,14-17H2,1-3H3,(H,26,27)(H,30,31)/b13-10+