4-[3-(4-fluorophenyl)-4-(2-oxidanylpropyl)-2H-1,2,3-triazol-1-yl]benzenecarbonitrile

Systemtic Name: 4-[3-(4-fluorophenyl)-4-(2-oxidanylpropyl)-2H-1,2,3-triazol-1-yl]benzenecarbonitrile Openeye Name: 4-[3-(4-fluorophenyl)-4-(2-hydroxypropyl)-2H-triazol-1-yl]benzonitrile CAS Name: 4-[3-(4-fluorophenyl)-4-(2-hydroxypropyl)-2H-triazol-1-yl]benzonitrile IUPAC Name: 4-[3-(4-fluorophenyl)-4-(2-hydroxypropyl)-2H-triazol-1-yl]benzonitrile Traditional Name: 4-[3-(4-fluorophenyl)-4-(2-hydroxypropyl)-2H-triazol-1-yl]benzonitrile Formula: C18H17FN4O MolecularWeight: 324.352183

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CN(NN1C2=CC=C(C=C2)F)C3=CC=C(C=C3)C#N)O

Isomeric SMILES

CC(CC1=CN(NN1C2=CC=C(C=C2)F)C3=CC=C(C=C3)C#N)O

InChI

InChI=1S/C18H17FN4O/c1-13(24)10-18-12-22(16-6-2-14(11-20)3-7-16)21-23(18)17-8-4-15(19)5-9-17/h2-9,12-13,21,24H,10H2,1H3