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

Systemtic Name: 2-[4-[(3-cyclopropyl-1,2,4-oxadiazol-5-yl)methyl]piperazin-4-ium-1-yl]phenol Openeye Name: 2-[4-[(3-cyclopropyl-1,2,4-oxadiazol-5-yl)methyl]piperazin-4-ium-1-yl]phenol CAS Name: 2-[4-[(3-cyclopropyl-1,2,4-oxadiazol-5-yl)methyl]-1-piperazin-4-iumyl]phenol IUPAC Name: 2-[4-[(3-cyclopropyl-1,2,4-oxadiazol-5-yl)methyl]piperazin-4-ium-1-yl]phenol Traditional Name: 2-[4-[(3-cyclopropyl-1,2,4-oxadiazol-5-yl)methyl]piperazin-4-ium-1-yl]phenol Formula: C16H21N4O2+ MolecularWeight: 301.36354

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NOC(=N2)C[NH+]3CCN(CC3)C4=CC=CC=C4O

Isomeric SMILES

C1CC1C2=NOC(=N2)C[NH+]3CCN(CC3)C4=CC=CC=C4O

InChI

InChI=1S/C16H20N4O2/c21-14-4-2-1-3-13(14)20-9-7-19(8-10-20)11-15-17-16(18-22-15)12-5-6-12/h1-4,12,21H,5-11H2/p+1