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

Systemtic Name: 4-[3-[5-azanylidene-3-(4-phenylbutyl)-1-oxa-3-azonia-2-azanidacyclopent-3-en-4-yl]propyl]-3-(4-phenylbutyl)-1-oxa-3-azonia-2-azanidacyclopent-3-en-5-imine Openeye Name: 4-[3-[5-imino-3-(4-phenylbutyl)-1-oxa-3-azonia-2-azanidacyclopent-3-en-4-yl]propyl]-3-(4-phenylbutyl)-1-oxa-3-azonia-2-azanidacyclopent-3-en-5-imine CAS Name: 4-[3-[5-imino-3-(4-phenylbutyl)-1-oxa-3-azonia-2-azanidacyclopent-3-en-4-yl]propyl]-3-(4-phenylbutyl)-1-oxa-3-azonia-2-azanidacyclopent-3-en-5-imine IUPAC Name: 4-[3-[5-imino-3-(4-phenylbutyl)-1-oxa-3-azonia-2-azanidacyclopent-3-en-4-yl]propyl]-3-(4-phenylbutyl)-1-oxa-3-azonia-2-azanidacyclopent-3-en-5-imine Traditional Name: [4-[3-[5-imino-3-(4-phenylbutyl)-1-oxa-3-azonia-2-azanidacyclopent-3-en-4-yl]propyl]-3-(4-phenylbutyl)-1-oxa-3-azonia-2-azanidacyclopent-3-en-5-ylidene]amine Formula: C27H34N6O2 MolecularWeight: 474.59786

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCC[N+]2=C(C(=N)O[N-]2)CCCC3=[N+]([N-]OC3=N)CCCCC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CCCC[N+]2=C(C(=N)O[N-]2)CCCC3=[N+]([N-]OC3=N)CCCCC4=CC=CC=C4

InChI

InChI=1S/C27H34N6O2/c28-26-24(32(30-34-26)20-9-7-16-22-12-3-1-4-13-22)18-11-19-25-27(29)35-31-33(25)21-10-8-17-23-14-5-2-6-15-23/h1-6,12-15,28-29H,7-11,16-21H2