N2-(4-ethoxyphenyl)-N3-[5-methyl-2-(1-methylbenzimidazol-2-yl)-1H-pyrazol-2-ium-3-yl]quinoxaline-2,3-diamine

Systemtic Name: N2-(4-ethoxyphenyl)-N3-[5-methyl-2-(1-methylbenzimidazol-2-yl)-1H-pyrazol-2-ium-3-yl]quinoxaline-2,3-diamine Openeye Name: N2-(4-ethoxyphenyl)-N3-[5-methyl-2-(1-methylbenzimidazol-2-yl)-1H-pyrazol-2-ium-3-yl]quinoxaline-2,3-diamine CAS Name: N2-(4-ethoxyphenyl)-N3-[5-methyl-2-(1-methyl-2-benzimidazolyl)-1H-pyrazol-2-ium-3-yl]quinoxaline-2,3-diamine IUPAC Name: 2-N-(4-ethoxyphenyl)-3-N-[5-methyl-2-(1-methylbenzimidazol-2-yl)-1H-pyrazol-2-ium-3-yl]quinoxaline-2,3-diamine Traditional Name: [5-methyl-2-(1-methylbenzimidazol-2-yl)-1H-pyrazol-2-ium-3-yl]-[3-(p-phenetidino)quinoxalin-2-yl]amine Formula: C28H27N8O+ MolecularWeight: 491.56698

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC2=NC3=CC=CC=C3N=C2NC4=[N+](NC(=C4)C)C5=NC6=CC=CC=C6N5C

Isomeric SMILES

CCOC1=CC=C(C=C1)NC2=NC3=CC=CC=C3N=C2NC4=[N+](NC(=C4)C)C5=NC6=CC=CC=C6N5C

InChI

InChI=1S/C28H26N8O/c1-4-37-20-15-13-19(14-16-20)29-26-27(31-22-10-6-5-9-21(22)30-26)33-25-17-18(2)34-36(25)28-32-23-11-7-8-12-24(23)35(28)3/h5-17H,4H2,1-3H3,(H2,29,30,31,33,34)/p+1