3-chloranyl-4-[2-oxidanylidene-2-(2,4,6-trimethylphenyl)ethoxy]benzenecarbonitrile

Systemtic Name: 3-chloranyl-4-[2-oxidanylidene-2-(2,4,6-trimethylphenyl)ethoxy]benzenecarbonitrile Openeye Name: 3-chloro-4-[2-oxo-2-(2,4,6-trimethylphenyl)ethoxy]benzonitrile CAS Name: 3-chloro-4-[2-oxo-2-(2,4,6-trimethylphenyl)ethoxy]benzonitrile IUPAC Name: 3-chloro-4-[2-oxo-2-(2,4,6-trimethylphenyl)ethoxy]benzonitrile Traditional Name: 3-chloro-4-(2-keto-2-mesityl-ethoxy)benzonitrile Formula: C18H16ClNO2 MolecularWeight: 313.77814

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)C(=O)COC2=C(C=C(C=C2)C#N)Cl)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)C(=O)COC2=C(C=C(C=C2)C#N)Cl)C

InChI

InChI=1S/C18H16ClNO2/c1-11-6-12(2)18(13(3)7-11)16(21)10-22-17-5-4-14(9-20)8-15(17)19/h4-8H,10H2,1-3H3