methyl (3S,5R)-3,5-di(butanoyloxy)-4-methyl-cyclohexane-1-carboxylate

Systemtic Name: methyl (3S,5R)-3,5-di(butanoyloxy)-4-methyl-cyclohexane-1-carboxylate Openeye Name: methyl (3S,5R)-3,5-di(butanoyloxy)-4-methyl-cyclohexanecarboxylate CAS Name: (3S,5R)-4-methyl-3,5-bis(1-oxobutoxy)-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl (3S,5R)-3,5-di(butanoyloxy)-4-methylcyclohexane-1-carboxylate Traditional Name: (3S,5R)-3,5-dibutyryloxy-4-methyl-cyclohexanecarboxylic acid methyl ester Formula: C17H28O6 MolecularWeight: 328.40062

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OC1CC(CC(C1C)OC(=O)CCC)C(=O)OC

Isomeric SMILES

CCCC(=O)O[C@@H]1CC(C[C@@H](C1C)OC(=O)CCC)C(=O)OC

InChI

InChI=1S/C17H28O6/c1-5-7-15(18)22-13-9-12(17(20)21-4)10-14(11(13)3)23-16(19)8-6-2/h11-14H,5-10H2,1-4H3/t11?,12?,13-,14+