7-[3-(azidomethyl)-2-[(E)-oct-1-enyl]-5-oxidanylidene-cyclopentyl]-2-methyl-2-oxidanyl-heptanoic acid

Systemtic Name: 7-[3-(azidomethyl)-2-[(E)-oct-1-enyl]-5-oxidanylidene-cyclopentyl]-2-methyl-2-oxidanyl-heptanoic acid Openeye Name: 7-[3-(azidomethyl)-2-[(E)-oct-1-enyl]-5-oxo-cyclopentyl]-2-hydroxy-2-methyl-heptanoic acid CAS Name: 7-[3-(azidomethyl)-2-[(E)-oct-1-enyl]-5-oxocyclopentyl]-2-hydroxy-2-methylheptanoic acid IUPAC Name: 7-[3-(azidomethyl)-2-[(E)-oct-1-enyl]-5-oxocyclopentyl]-2-hydroxy-2-methylheptanoic acid Traditional Name: 7-[3-(azidomethyl)-5-keto-2-[(E)-oct-1-enyl]cyclopentyl]-2-hydroxy-2-methyl-enanthic acid Formula: C22H37N3O4 MolecularWeight: 407.54688

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC=CC1C(CC(=O)C1CCCCCC(C)(C(=O)O)O)CN=[N+]=[N-]

Isomeric SMILES

CCCCCC/C=C/C1C(CC(=O)C1CCCCCC(C)(C(=O)O)O)CN=[N+]=[N-]

InChI

InChI=1S/C22H37N3O4/c1-3-4-5-6-7-9-12-18-17(16-24-25-23)15-20(26)19(18)13-10-8-11-14-22(2,29)21(27)28/h9,12,17-19,29H,3-8,10-11,13-16H2,1-2H3,(H,27,28)/b12-9+