(1,5-diphenyl-1,2,4-triazol-3-yl)-[4-(4-nitrophenyl)piperazin-1-yl]methanone

Systemtic Name: (1,5-diphenyl-1,2,4-triazol-3-yl)-[4-(4-nitrophenyl)piperazin-1-yl]methanone Openeye Name: (1,5-diphenyl-1,2,4-triazol-3-yl)-[4-(4-nitrophenyl)piperazin-1-yl]methanone CAS Name: (1,5-diphenyl-1,2,4-triazol-3-yl)-[4-(4-nitrophenyl)-1-piperazinyl]methanone IUPAC Name: (1,5-diphenyl-1,2,4-triazol-3-yl)-[4-(4-nitrophenyl)piperazin-1-yl]methanone Traditional Name: (1,5-diphenyl-1,2,4-triazol-3-yl)-[4-(4-nitrophenyl)piperazino]methanone Formula: C25H22N6O3 MolecularWeight: 454.48058

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C(=O)C3=NN(C(=N3)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C(=O)C3=NN(C(=N3)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C25H22N6O3/c32-25(29-17-15-28(16-18-29)20-11-13-22(14-12-20)31(33)34)23-26-24(19-7-3-1-4-8-19)30(27-23)21-9-5-2-6-10-21/h1-14H,15-18H2