N-[3-(2-fluoranylphenoxy)propyl]-2H-benzotriazole-5-carboxamide

Systemtic Name: N-[3-(2-fluoranylphenoxy)propyl]-2H-benzotriazole-5-carboxamide Openeye Name: N-[3-(2-fluorophenoxy)propyl]-2H-benzotriazole-5-carboxamide CAS Name: N-[3-(2-fluorophenoxy)propyl]-2H-benzotriazole-5-carboxamide IUPAC Name: N-[3-(2-fluorophenoxy)propyl]-2H-benzotriazole-5-carboxamide Traditional Name: N-[3-(2-fluorophenoxy)propyl]-2H-benzotriazole-5-carboxamide Formula: C16H15FN4O2 MolecularWeight: 314.314303

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)OCCCNC(=O)C2=CC3=NNN=C3C=C2)F

Isomeric SMILES

C1=CC=C(C(=C1)OCCCNC(=O)C2=CC3=NNN=C3C=C2)F

InChI

InChI=1S/C16H15FN4O2/c17-12-4-1-2-5-15(12)23-9-3-8-18-16(22)11-6-7-13-14(10-11)20-21-19-13/h1-2,4-7,10H,3,8-9H2,(H,18,22)(H,19,20,21)