N-methyl-5-[(2-methylbenzimidazol-1-yl)methyl]-N-[[(2S)-1-methylpyrrolidin-1-ium-2-yl]methyl]-1,2-oxazole-3-carboxamide

Systemtic Name: N-methyl-5-[(2-methylbenzimidazol-1-yl)methyl]-N-[[(2S)-1-methylpyrrolidin-1-ium-2-yl]methyl]-1,2-oxazole-3-carboxamide Openeye Name: N-methyl-5-[(2-methylbenzimidazol-1-yl)methyl]-N-[[(2S)-1-methylpyrrolidin-1-ium-2-yl]methyl]isoxazole-3-carboxamide CAS Name: N-methyl-5-[(2-methyl-1-benzimidazolyl)methyl]-N-[[(2S)-1-methyl-2-pyrrolidin-1-iumyl]methyl]-3-isoxazolecarboxamide IUPAC Name: N-methyl-5-[(2-methylbenzimidazol-1-yl)methyl]-N-[[(2S)-1-methylpyrrolidin-1-ium-2-yl]methyl]-1,2-oxazole-3-carboxamide Traditional Name: N-methyl-5-[(2-methylbenzimidazol-1-yl)methyl]-N-[[(2S)-1-methylpyrrolidin-1-ium-2-yl]methyl]isoxazole-3-carboxamide Formula: C20H26N5O2+ MolecularWeight: 368.45274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2N1CC3=CC(=NO3)C(=O)N(C)CC4CCC[NH+]4C

Isomeric SMILES

CC1=NC2=CC=CC=C2N1CC3=CC(=NO3)C(=O)N(C)C[C@@H]4CCC[NH+]4C

InChI

InChI=1S/C20H25N5O2/c1-14-21-17-8-4-5-9-19(17)25(14)13-16-11-18(22-27-16)20(26)24(3)12-15-7-6-10-23(15)2/h4-5,8-9,11,15H,6-7,10,12-13H2,1-3H3/p+1/t15-/m0/s1