ethyl (3R)-3-cyano-3-(3,4-dimethoxyphenyl)-2,2,4-trimethyl-pentanoate

Systemtic Name: ethyl (3R)-3-cyano-3-(3,4-dimethoxyphenyl)-2,2,4-trimethyl-pentanoate Openeye Name: ethyl (3R)-3-cyano-3-(3,4-dimethoxyphenyl)-2,2,4-trimethyl-pentanoate CAS Name: (3R)-3-cyano-3-(3,4-dimethoxyphenyl)-2,2,4-trimethylpentanoic acid ethyl ester IUPAC Name: ethyl (3R)-3-cyano-3-(3,4-dimethoxyphenyl)-2,2,4-trimethylpentanoate Traditional Name: (3R)-3-cyano-3-(3,4-dimethoxyphenyl)-2,2,4-trimethyl-valeric acid ethyl ester Formula: C19H27NO4 MolecularWeight: 333.42198

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCOC(=O)C(C)(C)[C@](C#N)(C1=CC(=C(C=C1)OC)OC)C(C)C

InChI

InChI=1S/C19H27NO4/c1-8-24-17(21)18(4,5)19(12-20,13(2)3)14-9-10-15(22-6)16(11-14)23-7/h9-11,13H,8H2,1-7H3/t19-/m0/s1