methyl (E)-7-[3-(oxan-2-yloxy)-2-(1,4-oxazepan-4-yl)-5-oxidanyl-cyclopentyl]hept-5-enoate

Systemtic Name: methyl (E)-7-[3-(oxan-2-yloxy)-2-(1,4-oxazepan-4-yl)-5-oxidanyl-cyclopentyl]hept-5-enoate Openeye Name: methyl (E)-7-[5-hydroxy-2-(1,4-oxazepan-4-yl)-3-tetrahydropyran-2-yloxy-cyclopentyl]hept-5-enoate CAS Name: (E)-7-[5-hydroxy-3-(2-oxanyloxy)-2-(1,4-oxazepan-4-yl)cyclopentyl]-5-heptenoic acid methyl ester IUPAC Name: methyl (E)-7-[5-hydroxy-3-(oxan-2-yloxy)-2-(1,4-oxazepan-4-yl)cyclopentyl]hept-5-enoate Traditional Name: (E)-7-[5-hydroxy-2-(1,4-oxazepan-4-yl)-3-tetrahydropyran-2-yloxy-cyclopentyl]hept-5-enoic acid methyl ester Formula: C23H39NO6 MolecularWeight: 425.55886

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCC=CCC1C(CC(C1N2CCCOCC2)OC3CCCCO3)O

Isomeric SMILES

COC(=O)CCC/C=C/CC1C(CC(C1N2CCCOCC2)OC3CCCCO3)O

InChI

InChI=1S/C23H39NO6/c1-27-21(26)10-5-3-2-4-9-18-19(25)17-20(30-22-11-6-7-15-29-22)23(18)24-12-8-14-28-16-13-24/h2,4,18-20,22-23,25H,3,5-17H2,1H3/b4-2+