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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C#N)C1(CCOC(C1)(C)C)CC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C(C#N)C1(CCOC(C1)(C)C)CC2=CC=CC=C2

InChI

InChI=1S/C19H25NO3/c1-4-22-17(21)16(13-20)19(10-11-23-18(2,3)14-19)12-15-8-6-5-7-9-15/h5-9,16H,4,10-12,14H2,1-3H3