5-(3,5-dinitrophenyl)-3-[4-phenyl-1-(phenylmethyl)piperidin-4-yl]-1,2,4-oxadiazole

Systemtic Name: 5-(3,5-dinitrophenyl)-3-[4-phenyl-1-(phenylmethyl)piperidin-4-yl]-1,2,4-oxadiazole Openeye Name: 3-(1-benzyl-4-phenyl-4-piperidyl)-5-(3,5-dinitrophenyl)-1,2,4-oxadiazole CAS Name: 5-(3,5-dinitrophenyl)-3-[4-phenyl-1-(phenylmethyl)-4-piperidinyl]-1,2,4-oxadiazole IUPAC Name: 3-(1-benzyl-4-phenylpiperidin-4-yl)-5-(3,5-dinitrophenyl)-1,2,4-oxadiazole Traditional Name: 3-(1-benzyl-4-phenyl-4-piperidyl)-5-(3,5-dinitrophenyl)-1,2,4-oxadiazole Formula: C26H23N5O5 MolecularWeight: 485.49132

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(C2=CC=CC=C2)C3=NOC(=N3)C4=CC(=CC(=C4)[N+](=O)[O-])[N+](=O)[O-])CC5=CC=CC=C5

Isomeric SMILES

C1CN(CCC1(C2=CC=CC=C2)C3=NOC(=N3)C4=CC(=CC(=C4)[N+](=O)[O-])[N+](=O)[O-])CC5=CC=CC=C5

InChI

InChI=1S/C26H23N5O5/c32-30(33)22-15-20(16-23(17-22)31(34)35)24-27-25(28-36-24)26(21-9-5-2-6-10-21)11-13-29(14-12-26)18-19-7-3-1-4-8-19/h1-10,15-17H,11-14,18H2