ethyl (3R,5R)-3-oxidanyl-5-phenylmethoxy-hept-6-ynoate

Systemtic Name: ethyl (3R,5R)-3-oxidanyl-5-phenylmethoxy-hept-6-ynoate Openeye Name: ethyl (3R,5R)-5-benzyloxy-3-hydroxy-hept-6-ynoate CAS Name: (3R,5R)-3-hydroxy-5-phenylmethoxy-6-heptynoic acid ethyl ester IUPAC Name: ethyl (3R,5R)-3-hydroxy-5-phenylmethoxyhept-6-ynoate Traditional Name: (3R,5R)-5-benzoxy-3-hydroxy-hept-6-ynoic acid ethyl ester Formula: C16H20O4 MolecularWeight: 276.3276

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(CC(C#C)OCC1=CC=CC=C1)O

Isomeric SMILES

CCOC(=O)C[C@@H](C[C@H](C#C)OCC1=CC=CC=C1)O

InChI

InChI=1S/C16H20O4/c1-3-15(10-14(17)11-16(18)19-4-2)20-12-13-8-6-5-7-9-13/h1,5-9,14-15,17H,4,10-12H2,2H3/t14-,15+/m1/s1