2-[[3-methyl-4-[(1,2,3-trimethyl-1H-benzimidazole-1,3-diium-5-yl)diazenyl]phenyl]amino]ethyl-pentan-3-yl-azanium

Systemtic Name: 2-[[3-methyl-4-[(1,2,3-trimethyl-1H-benzimidazole-1,3-diium-5-yl)diazenyl]phenyl]amino]ethyl-pentan-3-yl-azanium Openeye Name: 1-ethylpropyl-[2-[3-methyl-4-[(1,2,3-trimethyl-1H-benzimidazole-1,3-diium-5-yl)azo]anilino]ethyl]ammonium CAS Name: 2-[3-methyl-4-[(1,2,3-trimethyl-1H-benzimidazole-1,3-diium-5-yl)azo]anilino]ethyl-pentan-3-ylammonium IUPAC Name: 2-[3-methyl-4-[(1,2,3-trimethyl-1H-benzimidazole-1,3-diium-5-yl)diazenyl]anilino]ethyl-pentan-3-ylazanium Traditional Name: 1-ethylpropyl-[2-[3-methyl-4-[(1,2,3-trimethyl-1H-benzimidazole-1,3-diium-5-yl)azo]anilino]ethyl]ammonium Formula: C24H37N6+3 MolecularWeight: 409.59078

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)[NH2+]CCNC1=CC(=C(C=C1)N=NC2=CC3=C(C=C2)[NH+](C(=[N+]3C)C)C)C

Isomeric SMILES

CCC(CC)[NH2+]CCNC1=CC(=C(C=C1)N=NC2=CC3=C(C=C2)[NH+](C(=[N+]3C)C)C)C

InChI

InChI=1S/C24H35N6/c1-7-19(8-2)25-13-14-26-20-9-11-22(17(3)15-20)28-27-21-10-12-23-24(16-21)30(6)18(4)29(23)5/h9-12,15-16,19,25-26H,7-8,13-14H2,1-6H3/q+1/p+2