methyl (E,2S,5R,6S,7S)-2,5-dimethyl-6-oxidanyl-7-phenylmethoxy-oct-3-enoate

Systemtic Name: methyl (E,2S,5R,6S,7S)-2,5-dimethyl-6-oxidanyl-7-phenylmethoxy-oct-3-enoate Openeye Name: methyl (E,2S,5R,6S,7S)-7-benzyloxy-6-hydroxy-2,5-dimethyl-oct-3-enoate CAS Name: (E,2S,5R,6S,7S)-6-hydroxy-2,5-dimethyl-7-phenylmethoxy-3-octenoic acid methyl ester IUPAC Name: methyl (E,2S,5R,6S,7S)-6-hydroxy-2,5-dimethyl-7-phenylmethoxyoct-3-enoate Traditional Name: (E,2S,5R,6S,7S)-7-benzoxy-6-hydroxy-2,5-dimethyl-oct-3-enoic acid methyl ester Formula: C18H26O4 MolecularWeight: 306.39664

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Descriptors Computed from Structure

Canonical SMILES:

CC(C=CC(C)C(=O)OC)C(C(C)OCC1=CC=CC=C1)O

Isomeric SMILES

C[C@H](/C=C/[C@H](C)C(=O)OC)[C@@H]([C@H](C)OCC1=CC=CC=C1)O

InChI

InChI=1S/C18H26O4/c1-13(10-11-14(2)18(20)21-4)17(19)15(3)22-12-16-8-6-5-7-9-16/h5-11,13-15,17,19H,12H2,1-4H3/b11-10+/t13-,14+,15+,17+/m1/s1