methyl 4-[4-[[4-(1H-benzimidazol-2-yl)piperidin-1-ium-1-yl]methyl]-5-methyl-1,3-oxazol-2-yl]benzoate

Systemtic Name: methyl 4-[4-[[4-(1H-benzimidazol-2-yl)piperidin-1-ium-1-yl]methyl]-5-methyl-1,3-oxazol-2-yl]benzoate Openeye Name: methyl 4-[4-[[4-(1H-benzimidazol-2-yl)piperidin-1-ium-1-yl]methyl]-5-methyl-oxazol-2-yl]benzoate CAS Name: 4-[4-[[4-(1H-benzimidazol-2-yl)-1-piperidin-1-iumyl]methyl]-5-methyl-2-oxazolyl]benzoic acid methyl ester IUPAC Name: methyl 4-[4-[[4-(1H-benzimidazol-2-yl)piperidin-1-ium-1-yl]methyl]-5-methyl-1,3-oxazol-2-yl]benzoate Traditional Name: 4-[4-[[4-(1H-benzimidazol-2-yl)piperidin-1-ium-1-yl]methyl]-5-methyl-oxazol-2-yl]benzoic acid methyl ester Formula: C25H27N4O3+ MolecularWeight: 431.50688

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(O1)C2=CC=C(C=C2)C(=O)OC)C[NH+]3CCC(CC3)C4=NC5=CC=CC=C5N4

Isomeric SMILES

CC1=C(N=C(O1)C2=CC=C(C=C2)C(=O)OC)C[NH+]3CCC(CC3)C4=NC5=CC=CC=C5N4

InChI

InChI=1S/C25H26N4O3/c1-16-22(28-24(32-16)18-7-9-19(10-8-18)25(30)31-2)15-29-13-11-17(12-14-29)23-26-20-5-3-4-6-21(20)27-23/h3-10,17H,11-15H2,1-2H3,(H,26,27)/p+1