phenyl-[4-[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]piperazin-4-ium-1-yl]methanone

Systemtic Name: phenyl-[4-[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]piperazin-4-ium-1-yl]methanone Openeye Name: phenyl-[4-[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]piperazin-4-ium-1-yl]methanone CAS Name: phenyl-[4-[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]-1-piperazin-4-iumyl]methanone IUPAC Name: phenyl-[4-[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]piperazin-4-ium-1-yl]methanone Traditional Name: phenyl-[4-[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]piperazin-4-ium-1-yl]methanone Formula: C20H21N4O2+ MolecularWeight: 349.40634

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=NN=C(O2)C3=CC=CC=C3)C(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CC[NH+]1CC2=NN=C(O2)C3=CC=CC=C3)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C20H20N4O2/c25-20(17-9-5-2-6-10-17)24-13-11-23(12-14-24)15-18-21-22-19(26-18)16-7-3-1-4-8-16/h1-10H,11-15H2/p+1