2-(4-methyl-1-oxidanylidene-phthalazin-2-yl)-N-[1-methyl-2-(pyrrolidin-1-ium-1-ylmethyl)benzimidazol-5-yl]ethanamide

Systemtic Name: 2-(4-methyl-1-oxidanylidene-phthalazin-2-yl)-N-[1-methyl-2-(pyrrolidin-1-ium-1-ylmethyl)benzimidazol-5-yl]ethanamide Openeye Name: 2-(4-methyl-1-oxo-phthalazin-2-yl)-N-[1-methyl-2-(pyrrolidin-1-ium-1-ylmethyl)benzimidazol-5-yl]acetamide CAS Name: 2-(4-methyl-1-oxo-2-phthalazinyl)-N-[1-methyl-2-(1-pyrrolidin-1-iumylmethyl)-5-benzimidazolyl]acetamide IUPAC Name: 2-(4-methyl-1-oxophthalazin-2-yl)-N-[1-methyl-2-(pyrrolidin-1-ium-1-ylmethyl)benzimidazol-5-yl]acetamide Traditional Name: 2-(1-keto-4-methyl-phthalazin-2-yl)-N-[1-methyl-2-(pyrrolidin-1-ium-1-ylmethyl)benzimidazol-5-yl]acetamide Formula: C24H27N6O2+ MolecularWeight: 431.51018

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C2=CC=CC=C12)CC(=O)NC3=CC4=C(C=C3)N(C(=N4)C[NH+]5CCCC5)C

Isomeric SMILES

CC1=NN(C(=O)C2=CC=CC=C12)CC(=O)NC3=CC4=C(C=C3)N(C(=N4)C[NH+]5CCCC5)C

InChI

InChI=1S/C24H26N6O2/c1-16-18-7-3-4-8-19(18)24(32)30(27-16)15-23(31)25-17-9-10-21-20(13-17)26-22(28(21)2)14-29-11-5-6-12-29/h3-4,7-10,13H,5-6,11-12,14-15H2,1-2H3,(H,25,31)/p+1