4-ethyl-N-[2-(4-fluorophenyl)benzotriazol-5-yl]benzamide

Systemtic Name: 4-ethyl-N-[2-(4-fluorophenyl)benzotriazol-5-yl]benzamide Openeye Name: 4-ethyl-N-[2-(4-fluorophenyl)benzotriazol-5-yl]benzamide CAS Name: 4-ethyl-N-[2-(4-fluorophenyl)-5-benzotriazolyl]benzamide IUPAC Name: 4-ethyl-N-[2-(4-fluorophenyl)benzotriazol-5-yl]benzamide Traditional Name: 4-ethyl-N-[2-(4-fluorophenyl)benzotriazol-5-yl]benzamide Formula: C21H17FN4O MolecularWeight: 360.384283

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)NC2=CC3=NN(N=C3C=C2)C4=CC=C(C=C4)F

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)NC2=CC3=NN(N=C3C=C2)C4=CC=C(C=C4)F

InChI

InChI=1S/C21H17FN4O/c1-2-14-3-5-15(6-4-14)21(27)23-17-9-12-19-20(13-17)25-26(24-19)18-10-7-16(22)8-11-18/h3-13H,2H2,1H3,(H,23,27)