ethyl (E,4R,5R)-4-oxidanyl-5-phenylmethoxy-heptadec-2-enoate

Systemtic Name: ethyl (E,4R,5R)-4-oxidanyl-5-phenylmethoxy-heptadec-2-enoate Openeye Name: ethyl (E,4R,5R)-5-benzyloxy-4-hydroxy-heptadec-2-enoate CAS Name: (E,4R,5R)-4-hydroxy-5-phenylmethoxy-2-heptadecenoic acid ethyl ester IUPAC Name: ethyl (E,4R,5R)-4-hydroxy-5-phenylmethoxyheptadec-2-enoate Traditional Name: (E,4R,5R)-5-benzoxy-4-hydroxy-heptadec-2-enoic acid ethyl ester Formula: C26H42O4 MolecularWeight: 418.60928

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(C(C=CC(=O)OCC)O)OCC1=CC=CC=C1

Isomeric SMILES

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

InChI

InChI=1S/C26H42O4/c1-3-5-6-7-8-9-10-11-12-16-19-25(24(27)20-21-26(28)29-4-2)30-22-23-17-14-13-15-18-23/h13-15,17-18,20-21,24-25,27H,3-12,16,19,22H2,1-2H3/b21-20+/t24-,25-/m1/s1