N-[2-(4-butylphenyl)benzotriazol-5-yl]-3-fluoranyl-benzamide

Systemtic Name: N-[2-(4-butylphenyl)benzotriazol-5-yl]-3-fluoranyl-benzamide Openeye Name: N-[2-(4-butylphenyl)benzotriazol-5-yl]-3-fluoro-benzamide CAS Name: N-[2-(4-butylphenyl)-5-benzotriazolyl]-3-fluorobenzamide IUPAC Name: N-[2-(4-butylphenyl)benzotriazol-5-yl]-3-fluorobenzamide Traditional Name: N-[2-(4-butylphenyl)benzotriazol-5-yl]-3-fluoro-benzamide Formula: C23H21FN4O MolecularWeight: 388.437443

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)N2N=C3C=CC(=CC3=N2)NC(=O)C4=CC(=CC=C4)F

Isomeric SMILES

CCCCC1=CC=C(C=C1)N2N=C3C=CC(=CC3=N2)NC(=O)C4=CC(=CC=C4)F

InChI

InChI=1S/C23H21FN4O/c1-2-3-5-16-8-11-20(12-9-16)28-26-21-13-10-19(15-22(21)27-28)25-23(29)17-6-4-7-18(24)14-17/h4,6-15H,2-3,5H2,1H3,(H,25,29)