N-[5-(4-fluorophenyl)-1H-1,2,4-triazol-3-yl]-3-nitro-4-piperidin-1-yl-benzamide

Systemtic Name: N-[5-(4-fluorophenyl)-1H-1,2,4-triazol-3-yl]-3-nitro-4-piperidin-1-yl-benzamide Openeye Name: N-[5-(4-fluorophenyl)-1H-1,2,4-triazol-3-yl]-3-nitro-4-(1-piperidyl)benzamide CAS Name: N-[5-(4-fluorophenyl)-1H-1,2,4-triazol-3-yl]-3-nitro-4-(1-piperidinyl)benzamide IUPAC Name: N-[5-(4-fluorophenyl)-1H-1,2,4-triazol-3-yl]-3-nitro-4-piperidin-1-ylbenzamide Traditional Name: N-[5-(4-fluorophenyl)-1H-1,2,4-triazol-3-yl]-3-nitro-4-piperidino-benzamide Formula: C20H19FN6O3 MolecularWeight: 410.401663

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=C(C=C2)C(=O)NC3=NNC(=N3)C4=CC=C(C=C4)F)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)C2=C(C=C(C=C2)C(=O)NC3=NNC(=N3)C4=CC=C(C=C4)F)[N+](=O)[O-]

InChI

InChI=1S/C20H19FN6O3/c21-15-7-4-13(5-8-15)18-22-20(25-24-18)23-19(28)14-6-9-16(17(12-14)27(29)30)26-10-2-1-3-11-26/h4-9,12H,1-3,10-11H2,(H2,22,23,24,25,28)