4-[(2S)-1-(2,5-dimethylphenyl)-1-oxidanylidene-propan-2-yl]oxy-3-methoxy-benzenecarbonitrile

Systemtic Name: 4-[(2S)-1-(2,5-dimethylphenyl)-1-oxidanylidene-propan-2-yl]oxy-3-methoxy-benzenecarbonitrile Openeye Name: 4-[(1S)-2-(2,5-dimethylphenyl)-1-methyl-2-oxo-ethoxy]-3-methoxy-benzonitrile CAS Name: 4-[(2S)-1-(2,5-dimethylphenyl)-1-oxopropan-2-yl]oxy-3-methoxybenzonitrile IUPAC Name: 4-[(2S)-1-(2,5-dimethylphenyl)-1-oxopropan-2-yl]oxy-3-methoxybenzonitrile Traditional Name: 4-[(1S)-2-(2,5-dimethylphenyl)-2-keto-1-methyl-ethoxy]-3-methoxy-benzonitrile Formula: C19H19NO3 MolecularWeight: 309.35906

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C(=O)C(C)OC2=C(C=C(C=C2)C#N)OC

Isomeric SMILES

CC1=CC(=C(C=C1)C)C(=O)[C@H](C)OC2=C(C=C(C=C2)C#N)OC

InChI

InChI=1S/C19H19NO3/c1-12-5-6-13(2)16(9-12)19(21)14(3)23-17-8-7-15(11-20)10-18(17)22-4/h5-10,14H,1-4H3/t14-/m0/s1