methyl 7-[2-(3-ethoxy-4-methyl-4-phenoxy-pentyl)-3,5-bis(oxidanyl)cyclopentyl]heptanoate

Systemtic Name: methyl 7-[2-(3-ethoxy-4-methyl-4-phenoxy-pentyl)-3,5-bis(oxidanyl)cyclopentyl]heptanoate Openeye Name: methyl 7-[2-(3-ethoxy-4-methyl-4-phenoxy-pentyl)-3,5-dihydroxy-cyclopentyl]heptanoate CAS Name: 7-[2-(3-ethoxy-4-methyl-4-phenoxypentyl)-3,5-dihydroxycyclopentyl]heptanoic acid methyl ester IUPAC Name: methyl 7-[2-(3-ethoxy-4-methyl-4-phenoxypentyl)-3,5-dihydroxycyclopentyl]heptanoate Traditional Name: 7-[2-(3-ethoxy-4-methyl-4-phenoxy-pentyl)-3,5-dihydroxy-cyclopentyl]enanthic acid methyl ester Formula: C27H44O6 MolecularWeight: 464.63466

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(CCC1C(CC(C1CCCCCCC(=O)OC)O)O)C(C)(C)OC2=CC=CC=C2

Isomeric SMILES

CCOC(CCC1C(CC(C1CCCCCCC(=O)OC)O)O)C(C)(C)OC2=CC=CC=C2

InChI

InChI=1S/C27H44O6/c1-5-32-25(27(2,3)33-20-13-9-8-10-14-20)18-17-22-21(23(28)19-24(22)29)15-11-6-7-12-16-26(30)31-4/h8-10,13-14,21-25,28-29H,5-7,11-12,15-19H2,1-4H3