methyl (3S,5S,7S)-2-bromanyl-3,5,7-trimethyl-decanoate

Systemtic Name: methyl (3S,5S,7S)-2-bromanyl-3,5,7-trimethyl-decanoate Openeye Name: methyl (3S,5S,7S)-2-bromo-3,5,7-trimethyl-decanoate CAS Name: (3S,5S,7S)-2-bromo-3,5,7-trimethyldecanoic acid methyl ester IUPAC Name: methyl (3S,5S,7S)-2-bromo-3,5,7-trimethyldecanoate Traditional Name: (3S,5S,7S)-2-bromo-3,5,7-trimethyl-capric acid methyl ester Formula: C14H27BrO2 MolecularWeight: 307.26698

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)CC(C)CC(C)C(C(=O)OC)Br

Isomeric SMILES

CCC[C@H](C)C[C@H](C)C[C@H](C)C(C(=O)OC)Br

InChI

InChI=1S/C14H27BrO2/c1-6-7-10(2)8-11(3)9-12(4)13(15)14(16)17-5/h10-13H,6-9H2,1-5H3/t10-,11-,12-,13?/m0/s1