methyl (2R,3S,4S)-4-ethanoyl-3-[(4-methoxyphenyl)methoxy]-2-methyl-octanoate

Systemtic Name: methyl (2R,3S,4S)-4-ethanoyl-3-[(4-methoxyphenyl)methoxy]-2-methyl-octanoate Openeye Name: methyl (2R,3S,4S)-4-acetyl-3-[(4-methoxyphenyl)methoxy]-2-methyl-octanoate CAS Name: (2R,3S,4S)-4-acetyl-3-[(4-methoxyphenyl)methoxy]-2-methyloctanoic acid methyl ester IUPAC Name: methyl (2R,3S,4S)-4-acetyl-3-[(4-methoxyphenyl)methoxy]-2-methyloctanoate Traditional Name: (2R,3S,4S)-4-acetyl-2-methyl-3-p-anisyloxy-caprylic acid methyl ester Formula: C20H30O5 MolecularWeight: 350.4492

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(C(C)C(=O)OC)OCC1=CC=C(C=C1)OC)C(=O)C

Isomeric SMILES

CCCC[C@@H]([C@@H]([C@@H](C)C(=O)OC)OCC1=CC=C(C=C1)OC)C(=O)C

InChI

InChI=1S/C20H30O5/c1-6-7-8-18(15(3)21)19(14(2)20(22)24-5)25-13-16-9-11-17(23-4)12-10-16/h9-12,14,18-19H,6-8,13H2,1-5H3/t14-,18-,19-/m1/s1