methyl 2-cyano-2-(4-pentyloxan-4-yl)ethanoate

Systemtic Name: methyl 2-cyano-2-(4-pentyloxan-4-yl)ethanoate Openeye Name: methyl 2-cyano-2-(4-pentyltetrahydropyran-4-yl)acetate CAS Name: 2-cyano-2-(4-pentyl-4-oxanyl)acetic acid methyl ester IUPAC Name: methyl 2-cyano-2-(4-pentyloxan-4-yl)acetate Traditional Name: 2-(4-amyltetrahydropyran-4-yl)-2-cyano-acetic acid methyl ester Formula: C14H23NO3 MolecularWeight: 253.33732

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1(CCOCC1)C(C#N)C(=O)OC

Isomeric SMILES

CCCCCC1(CCOCC1)C(C#N)C(=O)OC

InChI

InChI=1S/C14H23NO3/c1-3-4-5-6-14(7-9-18-10-8-14)12(11-15)13(16)17-2/h12H,3-10H2,1-2H3