(1,3-dimethyl-2-oxidanylidene-benzimidazol-5-yl)methyl-phenethyl-(pyridin-4-ylmethyl)azanium

Systemtic Name: (1,3-dimethyl-2-oxidanylidene-benzimidazol-5-yl)methyl-phenethyl-(pyridin-4-ylmethyl)azanium Openeye Name: (1,3-dimethyl-2-oxo-benzimidazol-5-yl)methyl-phenethyl-(4-pyridylmethyl)ammonium CAS Name: (1,3-dimethyl-2-oxo-5-benzimidazolyl)methyl-phenethyl-(pyridin-4-ylmethyl)ammonium IUPAC Name: (1,3-dimethyl-2-oxobenzimidazol-5-yl)methyl-phenethyl-(pyridin-4-ylmethyl)azanium Traditional Name: (2-keto-1,3-dimethyl-benzimidazol-5-yl)methyl-phenethyl-(4-pyridylmethyl)ammonium Formula: C24H27N4O+ MolecularWeight: 387.49738

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)C[NH+](CCC3=CC=CC=C3)CC4=CC=NC=C4)N(C1=O)C

Isomeric SMILES

CN1C2=C(C=C(C=C2)C[NH+](CCC3=CC=CC=C3)CC4=CC=NC=C4)N(C1=O)C

InChI

InChI=1S/C24H26N4O/c1-26-22-9-8-21(16-23(22)27(2)24(26)29)18-28(17-20-10-13-25-14-11-20)15-12-19-6-4-3-5-7-19/h3-11,13-14,16H,12,15,17-18H2,1-2H3/p+1