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

Systemtic Name: 1-oxidanidyl-2-[4-[3-(4-phenylpiperazin-1-yl)propoxy]phenyl]benzotriazol-1-ium Openeye Name: 1-oxido-2-[4-[3-(4-phenylpiperazin-1-yl)propoxy]phenyl]benzotriazol-1-ium CAS Name: 1-oxido-2-[4-[3-(4-phenyl-1-piperazinyl)propoxy]phenyl]benzotriazol-1-ium IUPAC Name: 1-oxido-2-[4-[3-(4-phenylpiperazin-1-yl)propoxy]phenyl]benzotriazol-1-ium Traditional Name: 1-oxido-2-[4-[3-(4-phenylpiperazino)propoxy]phenyl]benzotriazol-1-ium Formula: C25H27N5O2 MolecularWeight: 429.51418

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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=C5

Isomeric SMILES

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

InChI

InChI=1S/C25H27N5O2/c31-30-25-10-5-4-9-24(25)26-29(30)22-11-13-23(14-12-22)32-20-6-15-27-16-18-28(19-17-27)21-7-2-1-3-8-21/h1-5,7-14H,6,15-20H2