2-cyclohexyl-N-methyl-N-[[(2S)-1-methylpiperidin-1-ium-2-yl]methyl]-1,3-benzoxazole-6-carboxamide

Systemtic Name: 2-cyclohexyl-N-methyl-N-[[(2S)-1-methylpiperidin-1-ium-2-yl]methyl]-1,3-benzoxazole-6-carboxamide Openeye Name: 2-cyclohexyl-N-methyl-N-[[(2S)-1-methylpiperidin-1-ium-2-yl]methyl]-1,3-benzoxazole-6-carboxamide CAS Name: 2-cyclohexyl-N-methyl-N-[[(2S)-1-methyl-2-piperidin-1-iumyl]methyl]-1,3-benzoxazole-6-carboxamide IUPAC Name: 2-cyclohexyl-N-methyl-N-[[(2S)-1-methylpiperidin-1-ium-2-yl]methyl]-1,3-benzoxazole-6-carboxamide Traditional Name: 2-cyclohexyl-N-methyl-N-[[(2S)-1-methylpiperidin-1-ium-2-yl]methyl]-1,3-benzoxazole-6-carboxamide Formula: C22H32N3O2+ MolecularWeight: 370.50838

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCCCC1CN(C)C(=O)C2=CC3=C(C=C2)N=C(O3)C4CCCCC4

Isomeric SMILES

C[NH+]1CCCC[C@H]1CN(C)C(=O)C2=CC3=C(C=C2)N=C(O3)C4CCCCC4

InChI

InChI=1S/C22H31N3O2/c1-24-13-7-6-10-18(24)15-25(2)22(26)17-11-12-19-20(14-17)27-21(23-19)16-8-4-3-5-9-16/h11-12,14,16,18H,3-10,13,15H2,1-2H3/p+1/t18-/m0/s1