N-(4-butan-2-ylphenyl)-4-cyano-2-fluoranyl-benzamide

Systemtic Name: N-(4-butan-2-ylphenyl)-4-cyano-2-fluoranyl-benzamide Openeye Name: 4-cyano-2-fluoro-N-(4-sec-butylphenyl)benzamide CAS Name: N-(4-butan-2-ylphenyl)-4-cyano-2-fluorobenzamide IUPAC Name: N-(4-butan-2-ylphenyl)-4-cyano-2-fluorobenzamide Traditional Name: 4-cyano-2-fluoro-N-(4-sec-butylphenyl)benzamide Formula: C18H17FN2O MolecularWeight: 296.338783

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)NC(=O)C2=C(C=C(C=C2)C#N)F

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)NC(=O)C2=C(C=C(C=C2)C#N)F

InChI

InChI=1S/C18H17FN2O/c1-3-12(2)14-5-7-15(8-6-14)21-18(22)16-9-4-13(11-20)10-17(16)19/h4-10,12H,3H2,1-2H3,(H,21,22)