4-[3,5-bis(5-azanylidene-3-pentyl-1-oxa-3-azonia-2-azanidacyclopent-3-en-4-yl)phenyl]-3-pentyl-1-oxa-3-azonia-2-azanidacyclopent-3-en-5-imine

Systemtic Name: 4-[3,5-bis(5-azanylidene-3-pentyl-1-oxa-3-azonia-2-azanidacyclopent-3-en-4-yl)phenyl]-3-pentyl-1-oxa-3-azonia-2-azanidacyclopent-3-en-5-imine Openeye Name: 4-[3,5-bis(5-imino-3-pentyl-1-oxa-3-azonia-2-azanidacyclopent-3-en-4-yl)phenyl]-3-pentyl-1-oxa-3-azonia-2-azanidacyclopent-3-en-5-imine CAS Name: 4-[3,5-bis(5-imino-3-pentyl-1-oxa-3-azonia-2-azanidacyclopent-3-en-4-yl)phenyl]-3-pentyl-1-oxa-3-azonia-2-azanidacyclopent-3-en-5-imine IUPAC Name: 4-[3,5-bis(5-imino-3-pentyl-1-oxa-3-azonia-2-azanidacyclopent-3-en-4-yl)phenyl]-3-pentyl-1-oxa-3-azonia-2-azanidacyclopent-3-en-5-imine Traditional Name: [3-amyl-4-[3,5-bis(3-amyl-5-imino-1-oxa-3-azonia-2-azanidacyclopent-3-en-4-yl)phenyl]-1-oxa-3-azonia-2-azanidacyclopent-3-en-5-ylidene]amine Formula: C27H39N9O3 MolecularWeight: 537.65706

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC[N+]1=C(C(=N)O[N-]1)C2=CC(=CC(=C2)C3=[N+]([N-]OC3=N)CCCCC)C4=[N+]([N-]OC4=N)CCCCC

Isomeric SMILES

CCCCC[N+]1=C(C(=N)O[N-]1)C2=CC(=CC(=C2)C3=[N+]([N-]OC3=N)CCCCC)C4=[N+]([N-]OC4=N)CCCCC

InChI

InChI=1S/C27H39N9O3/c1-4-7-10-13-34-22(25(28)37-31-34)19-16-20(23-26(29)38-32-35(23)14-11-8-5-2)18-21(17-19)24-27(30)39-33-36(24)15-12-9-6-3/h16-18,28-30H,4-15H2,1-3H3