3-chloranyl-4-[(2S)-1-(4-methylphenyl)-1-oxidanylidene-propan-2-yl]oxy-benzenecarbonitrile

Systemtic Name: 3-chloranyl-4-[(2S)-1-(4-methylphenyl)-1-oxidanylidene-propan-2-yl]oxy-benzenecarbonitrile Openeye Name: 3-chloro-4-[(1S)-1-methyl-2-oxo-2-(p-tolyl)ethoxy]benzonitrile CAS Name: 3-chloro-4-[(2S)-1-(4-methylphenyl)-1-oxopropan-2-yl]oxybenzonitrile IUPAC Name: 3-chloro-4-[(2S)-1-(4-methylphenyl)-1-oxopropan-2-yl]oxybenzonitrile Traditional Name: 3-chloro-4-[(1S)-2-keto-1-methyl-2-(p-tolyl)ethoxy]benzonitrile Formula: C17H14ClNO2 MolecularWeight: 299.75156

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H14ClNO2/c1-11-3-6-14(7-4-11)17(20)12(2)21-16-8-5-13(10-19)9-15(16)18/h3-9,12H,1-2H3/t12-/m0/s1