3-chloranyl-4-[1-(2,2-dimethylpropyl)piperidin-1-ium-4-yl]oxy-N-[(5-methylpyrazin-2-yl)methyl]benzamide

Systemtic Name: 3-chloranyl-4-[1-(2,2-dimethylpropyl)piperidin-1-ium-4-yl]oxy-N-[(5-methylpyrazin-2-yl)methyl]benzamide Openeye Name: 3-chloro-4-[1-(2,2-dimethylpropyl)piperidin-1-ium-4-yl]oxy-N-[(5-methylpyrazin-2-yl)methyl]benzamide CAS Name: 3-chloro-4-[[1-(2,2-dimethylpropyl)-4-piperidin-1-iumyl]oxy]-N-[(5-methyl-2-pyrazinyl)methyl]benzamide IUPAC Name: 3-chloro-4-[1-(2,2-dimethylpropyl)piperidin-1-ium-4-yl]oxy-N-[(5-methylpyrazin-2-yl)methyl]benzamide Traditional Name: 3-chloro-N-[(5-methylpyrazin-2-yl)methyl]-4-(1-neopentylpiperidin-1-ium-4-yl)oxy-benzamide Formula: C23H32ClN4O2+ MolecularWeight: 431.97878

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C=N1)CNC(=O)C2=CC(=C(C=C2)OC3CC[NH+](CC3)CC(C)(C)C)Cl

Isomeric SMILES

CC1=CN=C(C=N1)CNC(=O)C2=CC(=C(C=C2)OC3CC[NH+](CC3)CC(C)(C)C)Cl

InChI

InChI=1S/C23H31ClN4O2/c1-16-12-26-18(13-25-16)14-27-22(29)17-5-6-21(20(24)11-17)30-19-7-9-28(10-8-19)15-23(2,3)4/h5-6,11-13,19H,7-10,14-15H2,1-4H3,(H,27,29)/p+1