ethyl (E,4S,5S,7S)-7-[(4-methoxyphenyl)methoxy]-4-methyl-5-oxidanyl-9-phenylmethoxy-non-2-enoate

Systemtic Name: ethyl (E,4S,5S,7S)-7-[(4-methoxyphenyl)methoxy]-4-methyl-5-oxidanyl-9-phenylmethoxy-non-2-enoate Openeye Name: ethyl (E,4S,5S,7S)-9-benzyloxy-5-hydroxy-7-[(4-methoxyphenyl)methoxy]-4-methyl-non-2-enoate CAS Name: (E,4S,5S,7S)-5-hydroxy-7-[(4-methoxyphenyl)methoxy]-4-methyl-9-phenylmethoxy-2-nonenoic acid ethyl ester IUPAC Name: ethyl (E,4S,5S,7S)-5-hydroxy-7-[(4-methoxyphenyl)methoxy]-4-methyl-9-phenylmethoxynon-2-enoate Traditional Name: (E,4S,5S,7S)-9-benzoxy-5-hydroxy-4-methyl-7-p-anisyloxy-non-2-enoic acid ethyl ester Formula: C27H36O6 MolecularWeight: 456.57114

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC(C)C(CC(CCOCC1=CC=CC=C1)OCC2=CC=C(C=C2)OC)O

Isomeric SMILES

CCOC(=O)/C=C/[C@H](C)[C@H](C[C@H](CCOCC1=CC=CC=C1)OCC2=CC=C(C=C2)OC)O

InChI

InChI=1S/C27H36O6/c1-4-32-27(29)15-10-21(2)26(28)18-25(16-17-31-19-22-8-6-5-7-9-22)33-20-23-11-13-24(30-3)14-12-23/h5-15,21,25-26,28H,4,16-20H2,1-3H3/b15-10+/t21-,25-,26-/m0/s1