[(3S,4R)-4-bromanyl-2,5-dimethyl-hexan-3-yl] 3-methylbut-2-enoate

Systemtic Name: [(3S,4R)-4-bromanyl-2,5-dimethyl-hexan-3-yl] 3-methylbut-2-enoate Openeye Name: [(1S,2R)-2-bromo-1-isopropyl-3-methyl-butyl] 3-methylbut-2-enoate CAS Name: 3-methyl-2-butenoic acid [(3S,4R)-4-bromo-2,5-dimethylhexan-3-yl] ester IUPAC Name: [(3S,4R)-4-bromo-2,5-dimethylhexan-3-yl] 3-methylbut-2-enoate Traditional Name: 3-methylbut-2-enoic acid [(1S,2R)-2-bromo-1-isopropyl-3-methyl-butyl] ester Formula: C13H23BrO2 MolecularWeight: 291.22452

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H23BrO2/c1-8(2)7-11(15)16-13(10(5)6)12(14)9(3)4/h7,9-10,12-13H,1-6H3/t12-,13+/m1/s1