(2R)-2-(3,4-dimethoxyphenyl)-3-methyl-2-[(1R)-3-oxidanylidenecyclohexyl]butanenitrile

Systemtic Name: (2R)-2-(3,4-dimethoxyphenyl)-3-methyl-2-[(1R)-3-oxidanylidenecyclohexyl]butanenitrile Openeye Name: (2R)-2-(3,4-dimethoxyphenyl)-3-methyl-2-[(1R)-3-oxocyclohexyl]butanenitrile CAS Name: (2R)-2-(3,4-dimethoxyphenyl)-3-methyl-2-[(1R)-3-oxocyclohexyl]butanenitrile IUPAC Name: (2R)-2-(3,4-dimethoxyphenyl)-3-methyl-2-[(1R)-3-oxocyclohexyl]butanenitrile Traditional Name: (2R)-2-(3,4-dimethoxyphenyl)-2-[(1R)-3-ketocyclohexyl]-3-methyl-butyronitrile Formula: C19H25NO3 MolecularWeight: 315.4067

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C#N)(C1CCCC(=O)C1)C2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CC(C)[C@@](C#N)([C@@H]1CCCC(=O)C1)C2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C19H25NO3/c1-13(2)19(12-20,14-6-5-7-16(21)10-14)15-8-9-17(22-3)18(11-15)23-4/h8-9,11,13-14H,5-7,10H2,1-4H3/t14-,19+/m1/s1