(5S)-4-[(1R,3R,4R)-3-bromanyl-4-chloranyl-4-methyl-cyclohexyl]-5-methoxy-5-methyl-furan-2-one

Systemtic Name: (5S)-4-[(1R,3R,4R)-3-bromanyl-4-chloranyl-4-methyl-cyclohexyl]-5-methoxy-5-methyl-furan-2-one Openeye Name: (5S)-4-[(1R,3R,4R)-3-bromo-4-chloro-4-methyl-cyclohexyl]-5-methoxy-5-methyl-furan-2-one CAS Name: (5S)-4-[(1R,3R,4R)-3-bromo-4-chloro-4-methylcyclohexyl]-5-methoxy-5-methyl-2-furanone IUPAC Name: (5S)-4-[(1R,3R,4R)-3-bromo-4-chloro-4-methylcyclohexyl]-5-methoxy-5-methylfuran-2-one Traditional Name: (5S)-4-[(1R,3R,4R)-3-bromo-4-chloro-4-methyl-cyclohexyl]-5-methoxy-5-methyl-furan-2-one Formula: C13H18BrClO3 MolecularWeight: 337.63722

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC(CC1Br)C2=CC(=O)OC2(C)OC)Cl

Isomeric SMILES

C[C@]1(CC[C@H](C[C@H]1Br)C2=CC(=O)O[C@]2(C)OC)Cl

InChI

InChI=1S/C13H18BrClO3/c1-12(15)5-4-8(6-10(12)14)9-7-11(16)18-13(9,2)17-3/h7-8,10H,4-6H2,1-3H3/t8-,10-,12-,13+/m1/s1