methyl (2S,3S,5R)-6-[5-bromanyl-2-methoxy-3,6-di(propan-2-yloxy)phenyl]-3-methoxy-5-methyl-2-oxidanyl-hexanoate

Systemtic Name: methyl (2S,3S,5R)-6-[5-bromanyl-2-methoxy-3,6-di(propan-2-yloxy)phenyl]-3-methoxy-5-methyl-2-oxidanyl-hexanoate Openeye Name: methyl (2S,3S,5R)-6-(3-bromo-2,5-diisopropoxy-6-methoxy-phenyl)-2-hydroxy-3-methoxy-5-methyl-hexanoate CAS Name: (2S,3S,5R)-6-[5-bromo-2-methoxy-3,6-di(propan-2-yloxy)phenyl]-2-hydroxy-3-methoxy-5-methylhexanoic acid methyl ester IUPAC Name: methyl (2S,3S,5R)-6-[5-bromo-2-methoxy-3,6-di(propan-2-yloxy)phenyl]-2-hydroxy-3-methoxy-5-methylhexanoate Traditional Name: (2S,3S,5R)-6-(3-bromo-2,5-diisopropoxy-6-methoxy-phenyl)-2-hydroxy-3-methoxy-5-methyl-hexanoic acid methyl ester Formula: C22H35BrO7 MolecularWeight: 491.4131

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC(=C(C(=C1OC)CC(C)CC(C(C(=O)OC)O)OC)OC(C)C)Br

Isomeric SMILES

C[C@H](CC1=C(C(=CC(=C1OC(C)C)Br)OC(C)C)OC)C[C@@H]([C@@H](C(=O)OC)O)OC

InChI

InChI=1S/C22H35BrO7/c1-12(2)29-18-11-16(23)20(30-13(3)4)15(21(18)27-7)9-14(5)10-17(26-6)19(24)22(25)28-8/h11-14,17,19,24H,9-10H2,1-8H3/t14-,17+,19+/m1/s1