ethyl (5R)-7-cyano-5-oxidanyl-hept-2-ynoate

Systemtic Name: ethyl (5R)-7-cyano-5-oxidanyl-hept-2-ynoate Openeye Name: ethyl (5R)-7-cyano-5-hydroxy-hept-2-ynoate CAS Name: (5R)-7-cyano-5-hydroxy-2-heptynoic acid ethyl ester IUPAC Name: ethyl (5R)-7-cyano-5-hydroxyhept-2-ynoate Traditional Name: (5R)-7-cyano-5-hydroxy-hept-2-ynoic acid ethyl ester Formula: C10H13NO3 MolecularWeight: 195.21512

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C#CCC(CCC#N)O

Isomeric SMILES

CCOC(=O)C#CC[C@@H](CCC#N)O

InChI

InChI=1S/C10H13NO3/c1-2-14-10(13)7-3-5-9(12)6-4-8-11/h9,12H,2,4-6H2,1H3/t9-/m0/s1