N-(3-chloranyl-2,6-diethyl-phenyl)-2-(4-pyrrolidin-1-ylcarbonylpiperidin-1-ium-1-yl)ethanamide

Systemtic Name: N-(3-chloranyl-2,6-diethyl-phenyl)-2-(4-pyrrolidin-1-ylcarbonylpiperidin-1-ium-1-yl)ethanamide Openeye Name: N-(3-chloro-2,6-diethyl-phenyl)-2-[4-(pyrrolidine-1-carbonyl)piperidin-1-ium-1-yl]acetamide CAS Name: N-(3-chloro-2,6-diethylphenyl)-2-[4-[oxo(1-pyrrolidinyl)methyl]-1-piperidin-1-iumyl]acetamide IUPAC Name: N-(3-chloro-2,6-diethylphenyl)-2-[4-(pyrrolidine-1-carbonyl)piperidin-1-ium-1-yl]acetamide Traditional Name: N-(3-chloro-2,6-diethyl-phenyl)-2-[4-(pyrrolidine-1-carbonyl)piperidin-1-ium-1-yl]acetamide Formula: C22H33ClN3O2+ MolecularWeight: 406.96932

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(C=C1)Cl)CC)NC(=O)C[NH+]2CCC(CC2)C(=O)N3CCCC3

Isomeric SMILES

CCC1=C(C(=C(C=C1)Cl)CC)NC(=O)C[NH+]2CCC(CC2)C(=O)N3CCCC3

InChI

InChI=1S/C22H32ClN3O2/c1-3-16-7-8-19(23)18(4-2)21(16)24-20(27)15-25-13-9-17(10-14-25)22(28)26-11-5-6-12-26/h7-8,17H,3-6,9-15H2,1-2H3,(H,24,27)/p+1