[(1S,2R,3S,4R)-3-acetamido-4-(acetyloxymethyl)-2-cyclohexyl-3-methyl-cyclopentyl]methyl ethanoate

Systemtic Name: [(1S,2R,3S,4R)-3-acetamido-4-(acetyloxymethyl)-2-cyclohexyl-3-methyl-cyclopentyl]methyl ethanoate Openeye Name: [(1S,2R,3S,4R)-3-acetamido-4-(acetoxymethyl)-2-cyclohexyl-3-methyl-cyclopentyl]methyl acetate CAS Name: acetic acid [(1S,2R,3S,4R)-3-acetamido-4-(acetyloxymethyl)-2-cyclohexyl-3-methylcyclopentyl]methyl ester IUPAC Name: [(1S,2R,3S,4R)-3-acetamido-4-(acetyloxymethyl)-2-cyclohexyl-3-methylcyclopentyl]methyl acetate Traditional Name: acetic acid [(1S,2R,3S,4R)-3-acetamido-4-(acetoxymethyl)-2-cyclohexyl-3-methyl-cyclopentyl]methyl ester Formula: C20H33NO5 MolecularWeight: 367.47972

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1(C(CC(C1C2CCCCC2)COC(=O)C)COC(=O)C)C

Isomeric SMILES

CC(=O)N[C@@]1([C@@H](C[C@@H]([C@H]1C2CCCCC2)COC(=O)C)COC(=O)C)C

InChI

InChI=1S/C20H33NO5/c1-13(22)21-20(4)18(12-26-15(3)24)10-17(11-25-14(2)23)19(20)16-8-6-5-7-9-16/h16-19H,5-12H2,1-4H3,(H,21,22)/t17-,18+,19-,20-/m1/s1