4-[2-[5-azanylidene-3-(4-phenylbutyl)-1-oxa-3-azonia-2-azanidacyclopent-3-en-4-yl]ethyl]-3-(4-phenylbutyl)-1-oxa-3-azonia-2-azanidacyclopent-3-en-5-imine

Systemtic Name: 4-[2-[5-azanylidene-3-(4-phenylbutyl)-1-oxa-3-azonia-2-azanidacyclopent-3-en-4-yl]ethyl]-3-(4-phenylbutyl)-1-oxa-3-azonia-2-azanidacyclopent-3-en-5-imine Openeye Name: 4-[2-[5-imino-3-(4-phenylbutyl)-1-oxa-3-azonia-2-azanidacyclopent-3-en-4-yl]ethyl]-3-(4-phenylbutyl)-1-oxa-3-azonia-2-azanidacyclopent-3-en-5-imine CAS Name: 4-[2-[5-imino-3-(4-phenylbutyl)-1-oxa-3-azonia-2-azanidacyclopent-3-en-4-yl]ethyl]-3-(4-phenylbutyl)-1-oxa-3-azonia-2-azanidacyclopent-3-en-5-imine IUPAC Name: 4-[2-[5-imino-3-(4-phenylbutyl)-1-oxa-3-azonia-2-azanidacyclopent-3-en-4-yl]ethyl]-3-(4-phenylbutyl)-1-oxa-3-azonia-2-azanidacyclopent-3-en-5-imine Traditional Name: [4-[2-[5-imino-3-(4-phenylbutyl)-1-oxa-3-azonia-2-azanidacyclopent-3-en-4-yl]ethyl]-3-(4-phenylbutyl)-1-oxa-3-azonia-2-azanidacyclopent-3-en-5-ylidene]amine Formula: C26H32N6O2 MolecularWeight: 460.57128

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCC[N+]2=C(C(=N)O[N-]2)CCC3=[N+]([N-]OC3=N)CCCCC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CCCC[N+]2=C(C(=N)O[N-]2)CCC3=[N+]([N-]OC3=N)CCCCC4=CC=CC=C4

InChI

InChI=1S/C26H32N6O2/c27-25-23(31(29-33-25)19-9-7-15-21-11-3-1-4-12-21)17-18-24-26(28)34-30-32(24)20-10-8-16-22-13-5-2-6-14-22/h1-6,11-14,27-28H,7-10,15-20H2