methyl (1R,2R,6R)-2-[(2S)-2-(5-bromanylfuran-2-yl)-2-oxidanyl-ethyl]-3-methyl-6-propan-2-yl-cyclohex-3-ene-1-carboxylate

Systemtic Name: methyl (1R,2R,6R)-2-[(2S)-2-(5-bromanylfuran-2-yl)-2-oxidanyl-ethyl]-3-methyl-6-propan-2-yl-cyclohex-3-ene-1-carboxylate Openeye Name: methyl (1R,2R,6R)-2-[(2S)-2-(5-bromo-2-furyl)-2-hydroxy-ethyl]-6-isopropyl-3-methyl-cyclohex-3-ene-1-carboxylate CAS Name: (1R,2R,6R)-2-[(2S)-2-(5-bromo-2-furanyl)-2-hydroxyethyl]-3-methyl-6-propan-2-yl-1-cyclohex-3-enecarboxylic acid methyl ester IUPAC Name: methyl (1R,2R,6R)-2-[(2S)-2-(5-bromofuran-2-yl)-2-hydroxyethyl]-3-methyl-6-propan-2-ylcyclohex-3-ene-1-carboxylate Traditional Name: (1R,2R,6R)-2-[(2S)-2-(5-bromo-2-furyl)-2-hydroxy-ethyl]-6-isopropyl-3-methyl-cyclohex-3-ene-1-carboxylic acid methyl ester Formula: C18H25BrO4 MolecularWeight: 385.2927

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CCC(C(C1CC(C2=CC=C(O2)Br)O)C(=O)OC)C(C)C

Isomeric SMILES

CC1=CC[C@@H]([C@H]([C@H]1C[C@@H](C2=CC=C(O2)Br)O)C(=O)OC)C(C)C

InChI

InChI=1S/C18H25BrO4/c1-10(2)12-6-5-11(3)13(17(12)18(21)22-4)9-14(20)15-7-8-16(19)23-15/h5,7-8,10,12-14,17,20H,6,9H2,1-4H3/t12-,13+,14+,17-/m1/s1