methyl 2-cyano-3-methyl-4-phenylmethoxy-butanoate

Systemtic Name: methyl 2-cyano-3-methyl-4-phenylmethoxy-butanoate Openeye Name: methyl 4-benzyloxy-2-cyano-3-methyl-butanoate CAS Name: 2-cyano-3-methyl-4-phenylmethoxybutanoic acid methyl ester IUPAC Name: methyl 2-cyano-3-methyl-4-phenylmethoxybutanoate Traditional Name: 4-benzoxy-2-cyano-3-methyl-butyric acid methyl ester Formula: C14H17NO3 MolecularWeight: 247.28968

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Descriptors Computed from Structure

Canonical SMILES:

CC(COCC1=CC=CC=C1)C(C#N)C(=O)OC

Isomeric SMILES

CC(COCC1=CC=CC=C1)C(C#N)C(=O)OC

InChI

InChI=1S/C14H17NO3/c1-11(13(8-15)14(16)17-2)9-18-10-12-6-4-3-5-7-12/h3-7,11,13H,9-10H2,1-2H3