methyl 2-[(3S,5R)-5-[6-(4-chloranyl-2-phenylmethoxy-phenyl)hexyl]-3-oxidanyl-2-oxidanylidene-oxolan-3-yl]ethanoate

Systemtic Name: methyl 2-[(3S,5R)-5-[6-(4-chloranyl-2-phenylmethoxy-phenyl)hexyl]-3-oxidanyl-2-oxidanylidene-oxolan-3-yl]ethanoate Openeye Name: methyl 2-[(3S,5R)-5-[6-(2-benzyloxy-4-chloro-phenyl)hexyl]-3-hydroxy-2-oxo-tetrahydrofuran-3-yl]acetate CAS Name: 2-[(3S,5R)-5-[6-(4-chloro-2-phenylmethoxyphenyl)hexyl]-3-hydroxy-2-oxo-3-oxolanyl]acetic acid methyl ester IUPAC Name: methyl 2-[(3S,5R)-5-[6-(4-chloro-2-phenylmethoxyphenyl)hexyl]-3-hydroxy-2-oxooxolan-3-yl]acetate Traditional Name: 2-[(3S,5R)-5-[6-(2-benzoxy-4-chloro-phenyl)hexyl]-3-hydroxy-2-keto-tetrahydrofuran-3-yl]acetic acid methyl ester Formula: C26H31ClO6 MolecularWeight: 474.97374

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1(CC(OC1=O)CCCCCCC2=C(C=C(C=C2)Cl)OCC3=CC=CC=C3)O

Isomeric SMILES

COC(=O)C[C@]1(C[C@H](OC1=O)CCCCCCC2=C(C=C(C=C2)Cl)OCC3=CC=CC=C3)O

InChI

InChI=1S/C26H31ClO6/c1-31-24(28)17-26(30)16-22(33-25(26)29)12-8-3-2-7-11-20-13-14-21(27)15-23(20)32-18-19-9-5-4-6-10-19/h4-6,9-10,13-15,22,30H,2-3,7-8,11-12,16-18H2,1H3/t22-,26+/m1/s1