ethyl 4-acetyloxy-2-cyano-7-methoxy-7-methyl-oct-5-ynoate

Systemtic Name: ethyl 4-acetyloxy-2-cyano-7-methoxy-7-methyl-oct-5-ynoate Openeye Name: ethyl 4-acetoxy-2-cyano-7-methoxy-7-methyl-oct-5-ynoate CAS Name: 4-acetyloxy-2-cyano-7-methoxy-7-methyl-5-octynoic acid ethyl ester IUPAC Name: ethyl 4-acetyloxy-2-cyano-7-methoxy-7-methyloct-5-ynoate Traditional Name: 4-acetoxy-2-cyano-7-methoxy-7-methyl-oct-5-ynoic acid ethyl ester Formula: C15H21NO5 MolecularWeight: 295.33094

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC(C#CC(C)(C)OC)OC(=O)C)C#N

Isomeric SMILES

CCOC(=O)C(CC(C#CC(C)(C)OC)OC(=O)C)C#N

InChI

InChI=1S/C15H21NO5/c1-6-20-14(18)12(10-16)9-13(21-11(2)17)7-8-15(3,4)19-5/h12-13H,6,9H2,1-5H3