ethyl 4-(2-cyano-2-methyl-hexoxy)benzoate

Systemtic Name: ethyl 4-(2-cyano-2-methyl-hexoxy)benzoate Openeye Name: ethyl 4-(2-cyano-2-methyl-hexoxy)benzoate CAS Name: 4-(2-cyano-2-methylhexoxy)benzoic acid ethyl ester IUPAC Name: ethyl 4-(2-cyano-2-methylhexoxy)benzoate Traditional Name: 4-(2-cyano-2-methyl-hexoxy)benzoic acid ethyl ester Formula: C17H23NO3 MolecularWeight: 289.36942

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)(COC1=CC=C(C=C1)C(=O)OCC)C#N

Isomeric SMILES

CCCCC(C)(COC1=CC=C(C=C1)C(=O)OCC)C#N

InChI

InChI=1S/C17H23NO3/c1-4-6-11-17(3,12-18)13-21-15-9-7-14(8-10-15)16(19)20-5-2/h7-10H,4-6,11,13H2,1-3H3