3-chloranyl-4-[1-(2,2-dimethylpropyl)piperidin-1-ium-4-yl]oxy-N-(2-pyrazin-2-ylethyl)benzamide

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C[NH+]1CCC(CC1)OC2=C(C=C(C=C2)C(=O)NCCC3=NC=CN=C3)Cl

Isomeric SMILES

CC(C)(C)C[NH+]1CCC(CC1)OC2=C(C=C(C=C2)C(=O)NCCC3=NC=CN=C3)Cl

InChI

InChI=1S/C23H31ClN4O2/c1-23(2,3)16-28-12-7-19(8-13-28)30-21-5-4-17(14-20(21)24)22(29)27-9-6-18-15-25-10-11-26-18/h4-5,10-11,14-15,19H,6-9,12-13,16H2,1-3H3,(H,27,29)/p+1