3-[4-(phenylmethyl)piperazin-1-yl]-1-oxa-3-azonia-2-azanidacyclopent-3-en-5-imine

Systemtic Name: 3-[4-(phenylmethyl)piperazin-1-yl]-1-oxa-3-azonia-2-azanidacyclopent-3-en-5-imine Openeye Name: 3-(4-benzylpiperazin-1-yl)-1-oxa-3-azonia-2-azanidacyclopent-3-en-5-imine CAS Name: 3-[4-(phenylmethyl)-1-piperazinyl]-1-oxa-3-azonia-2-azanidacyclopent-3-en-5-imine IUPAC Name: 3-(4-benzylpiperazin-1-yl)-1-oxa-3-azonia-2-azanidacyclopent-3-en-5-imine Traditional Name: [3-(4-benzylpiperazino)-1-oxa-3-azonia-2-azanidacyclopent-3-en-5-ylidene]amine Formula: C13H17N5O MolecularWeight: 259.30698

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)[N+]3=CC(=N)O[N-]3

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)[N+]3=CC(=N)O[N-]3

InChI

InChI=1S/C13H17N5O/c14-13-11-18(15-19-13)17-8-6-16(7-9-17)10-12-4-2-1-3-5-12/h1-5,11,14H,6-10H2