N-(2,4-dimethylphenyl)-2-[4-(6-methyl-1H-benzimidazol-2-yl)piperidin-1-ium-1-yl]ethanamide

Systemtic Name: N-(2,4-dimethylphenyl)-2-[4-(6-methyl-1H-benzimidazol-2-yl)piperidin-1-ium-1-yl]ethanamide Openeye Name: N-(2,4-dimethylphenyl)-2-[4-(6-methyl-1H-benzimidazol-2-yl)piperidin-1-ium-1-yl]acetamide CAS Name: N-(2,4-dimethylphenyl)-2-[4-(6-methyl-1H-benzimidazol-2-yl)-1-piperidin-1-iumyl]acetamide IUPAC Name: N-(2,4-dimethylphenyl)-2-[4-(6-methyl-1H-benzimidazol-2-yl)piperidin-1-ium-1-yl]acetamide Traditional Name: N-(2,4-dimethylphenyl)-2-[4-(6-methyl-1H-benzimidazol-2-yl)piperidin-1-ium-1-yl]acetamide Formula: C23H29N4O+ MolecularWeight: 377.50256

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C[NH+]2CCC(CC2)C3=NC4=C(N3)C=C(C=C4)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C[NH+]2CCC(CC2)C3=NC4=C(N3)C=C(C=C4)C)C

InChI

InChI=1S/C23H28N4O/c1-15-4-6-19(17(3)12-15)24-22(28)14-27-10-8-18(9-11-27)23-25-20-7-5-16(2)13-21(20)26-23/h4-7,12-13,18H,8-11,14H2,1-3H3,(H,24,28)(H,25,26)/p+1