(2S)-5-chloranyl-2-(3,4-dimethoxyphenyl)-2-propan-2-yl-pentanenitrile

Systemtic Name: (2S)-5-chloranyl-2-(3,4-dimethoxyphenyl)-2-propan-2-yl-pentanenitrile Openeye Name: (2S)-5-chloro-2-(3,4-dimethoxyphenyl)-2-isopropyl-pentanenitrile CAS Name: (2S)-5-chloro-2-(3,4-dimethoxyphenyl)-2-propan-2-ylpentanenitrile IUPAC Name: (2S)-5-chloro-2-(3,4-dimethoxyphenyl)-2-propan-2-ylpentanenitrile Traditional Name: (2S)-5-chloro-2-(3,4-dimethoxyphenyl)-2-isopropyl-valeronitrile Formula: C16H22ClNO2 MolecularWeight: 295.80438

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CCCCl)(C#N)C1=CC(=C(C=C1)OC)OC

Isomeric SMILES

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

InChI

InChI=1S/C16H22ClNO2/c1-12(2)16(11-18,8-5-9-17)13-6-7-14(19-3)15(10-13)20-4/h6-7,10,12H,5,8-9H2,1-4H3/t16-/m0/s1