[5-[(4-fluorophenyl)methylamino]-3-phenyl-1,2,4-triazol-1-yl]-(4-nitrophenyl)methanone

Systemtic Name: [5-[(4-fluorophenyl)methylamino]-3-phenyl-1,2,4-triazol-1-yl]-(4-nitrophenyl)methanone Openeye Name: [5-[(4-fluorophenyl)methylamino]-3-phenyl-1,2,4-triazol-1-yl]-(4-nitrophenyl)methanone CAS Name: [5-[(4-fluorophenyl)methylamino]-3-phenyl-1,2,4-triazol-1-yl]-(4-nitrophenyl)methanone IUPAC Name: [5-[(4-fluorophenyl)methylamino]-3-phenyl-1,2,4-triazol-1-yl]-(4-nitrophenyl)methanone Traditional Name: [5-[(4-fluorobenzyl)amino]-3-phenyl-1,2,4-triazol-1-yl]-(4-nitrophenyl)methanone Formula: C22H16FN5O3 MolecularWeight: 417.392543

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(C(=N2)NCC3=CC=C(C=C3)F)C(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=NN(C(=N2)NCC3=CC=C(C=C3)F)C(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H16FN5O3/c23-18-10-6-15(7-11-18)14-24-22-25-20(16-4-2-1-3-5-16)26-27(22)21(29)17-8-12-19(13-9-17)28(30)31/h1-13H,14H2,(H,24,25,26)