1-oxidanidyl-2-[4-[3-(4-pyridin-2-ylpiperazin-1-yl)propoxy]phenyl]benzotriazol-1-ium

Systemtic Name: 1-oxidanidyl-2-[4-[3-(4-pyridin-2-ylpiperazin-1-yl)propoxy]phenyl]benzotriazol-1-ium Openeye Name: 1-oxido-2-[4-[3-[4-(2-pyridyl)piperazin-1-yl]propoxy]phenyl]benzotriazol-1-ium CAS Name: 1-oxido-2-[4-[3-[4-(2-pyridinyl)-1-piperazinyl]propoxy]phenyl]benzotriazol-1-ium IUPAC Name: 1-oxido-2-[4-[3-(4-pyridin-2-ylpiperazin-1-yl)propoxy]phenyl]benzotriazol-1-ium Traditional Name: 1-oxido-2-[4-[3-[4-(2-pyridyl)piperazino]propoxy]phenyl]benzotriazol-1-ium Formula: C24H26N6O2 MolecularWeight: 430.50224

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCOC2=CC=C(C=C2)N3N=C4C=CC=CC4=[N+]3[O-])C5=CC=CC=N5

Isomeric SMILES

C1CN(CCN1CCCOC2=CC=C(C=C2)N3N=C4C=CC=CC4=[N+]3[O-])C5=CC=CC=N5

InChI

InChI=1S/C24H26N6O2/c31-30-23-7-2-1-6-22(23)26-29(30)20-9-11-21(12-10-20)32-19-5-14-27-15-17-28(18-16-27)24-8-3-4-13-25-24/h1-4,6-13H,5,14-19H2