4-[(3-ethynylphenyl)amino]-2-(trifluoromethyl)benzenecarbonitrile

Systemtic Name: 4-[(3-ethynylphenyl)amino]-2-(trifluoromethyl)benzenecarbonitrile Openeye Name: 4-(3-ethynylanilino)-2-(trifluoromethyl)benzonitrile CAS Name: 4-(3-ethynylanilino)-2-(trifluoromethyl)benzonitrile IUPAC Name: 4-(3-ethynylanilino)-2-(trifluoromethyl)benzonitrile Traditional Name: 4-(3-ethynylanilino)-2-(trifluoromethyl)benzonitrile Formula: C16H9F3N2 MolecularWeight: 286.25127

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=CC(=CC=C1)NC2=CC(=C(C=C2)C#N)C(F)(F)F

Isomeric SMILES

C#CC1=CC(=CC=C1)NC2=CC(=C(C=C2)C#N)C(F)(F)F

InChI

InChI=1S/C16H9F3N2/c1-2-11-4-3-5-13(8-11)21-14-7-6-12(10-20)15(9-14)16(17,18)19/h1,3-9,21H