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

Systemtic Name: 3-chloranyl-4-[1-(2,2-dimethylpropyl)piperidin-1-ium-4-yl]oxy-N-(3-imidazol-1-ylpropyl)benzamide Openeye Name: 3-chloro-4-[1-(2,2-dimethylpropyl)piperidin-1-ium-4-yl]oxy-N-(3-imidazol-1-ylpropyl)benzamide CAS Name: 3-chloro-4-[[1-(2,2-dimethylpropyl)-4-piperidin-1-iumyl]oxy]-N-[3-(1-imidazolyl)propyl]benzamide IUPAC Name: 3-chloro-4-[1-(2,2-dimethylpropyl)piperidin-1-ium-4-yl]oxy-N-(3-imidazol-1-ylpropyl)benzamide Traditional Name: 3-chloro-N-(3-imidazol-1-ylpropyl)-4-(1-neopentylpiperidin-1-ium-4-yl)oxy-benzamide Formula: C23H34ClN4O2+ MolecularWeight: 433.99466

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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)NCCCN3C=CN=C3)Cl

Isomeric SMILES

CC(C)(C)C[NH+]1CCC(CC1)OC2=C(C=C(C=C2)C(=O)NCCCN3C=CN=C3)Cl

InChI

InChI=1S/C23H33ClN4O2/c1-23(2,3)16-27-12-7-19(8-13-27)30-21-6-5-18(15-20(21)24)22(29)26-9-4-11-28-14-10-25-17-28/h5-6,10,14-15,17,19H,4,7-9,11-13,16H2,1-3H3,(H,26,29)/p+1