methyl (3R,6S)-3,7-dimethyl-6-oxidanyl-octanoate

Systemtic Name: methyl (3R,6S)-3,7-dimethyl-6-oxidanyl-octanoate Openeye Name: methyl (3R,6S)-6-hydroxy-3,7-dimethyl-octanoate CAS Name: (3R,6S)-6-hydroxy-3,7-dimethyloctanoic acid methyl ester IUPAC Name: methyl (3R,6S)-6-hydroxy-3,7-dimethyloctanoate Traditional Name: (3R,6S)-6-hydroxy-3,7-dimethyl-caprylic acid methyl ester Formula: C11H22O3 MolecularWeight: 202.29058

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CCC(C)CC(=O)OC)O

Isomeric SMILES

C[C@H](CC[C@@H](C(C)C)O)CC(=O)OC

InChI

InChI=1S/C11H22O3/c1-8(2)10(12)6-5-9(3)7-11(13)14-4/h8-10,12H,5-7H2,1-4H3/t9-,10+/m1/s1