ethyl 2-cyano-2-[2,2-dimethyl-4-(4-methylphenyl)oxan-4-yl]ethanoate

Systemtic Name: ethyl 2-cyano-2-[2,2-dimethyl-4-(4-methylphenyl)oxan-4-yl]ethanoate Openeye Name: ethyl 2-cyano-2-[2,2-dimethyl-4-(p-tolyl)tetrahydropyran-4-yl]acetate CAS Name: 2-cyano-2-[2,2-dimethyl-4-(4-methylphenyl)-4-oxanyl]acetic acid ethyl ester IUPAC Name: ethyl 2-cyano-2-[2,2-dimethyl-4-(4-methylphenyl)oxan-4-yl]acetate Traditional Name: 2-cyano-2-[2,2-dimethyl-4-(p-tolyl)tetrahydropyran-4-yl]acetic acid ethyl ester Formula: C19H25NO3 MolecularWeight: 315.4067

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C#N)C1(CCOC(C1)(C)C)C2=CC=C(C=C2)C

Isomeric SMILES

CCOC(=O)C(C#N)C1(CCOC(C1)(C)C)C2=CC=C(C=C2)C

InChI

InChI=1S/C19H25NO3/c1-5-22-17(21)16(12-20)19(10-11-23-18(3,4)13-19)15-8-6-14(2)7-9-15/h6-9,16H,5,10-11,13H2,1-4H3