(3S)-N-[2-(3,5-dimethylpyrazol-1-yl)ethyl]-N-methyl-1-(1-methylpiperidin-1-ium-4-yl)piperidin-1-ium-3-carboxamide

Systemtic Name: (3S)-N-[2-(3,5-dimethylpyrazol-1-yl)ethyl]-N-methyl-1-(1-methylpiperidin-1-ium-4-yl)piperidin-1-ium-3-carboxamide Openeye Name: (3S)-N-[2-(3,5-dimethylpyrazol-1-yl)ethyl]-N-methyl-1-(1-methylpiperidin-1-ium-4-yl)piperidin-1-ium-3-carboxamide CAS Name: (3S)-N-[2-(3,5-dimethyl-1-pyrazolyl)ethyl]-N-methyl-1-(1-methyl-4-piperidin-1-iumyl)-3-piperidin-1-iumcarboxamide IUPAC Name: (3S)-N-[2-(3,5-dimethylpyrazol-1-yl)ethyl]-N-methyl-1-(1-methylpiperidin-1-ium-4-yl)piperidin-1-ium-3-carboxamide Traditional Name: (3S)-N-[2-(3,5-dimethylpyrazol-1-yl)ethyl]-N-methyl-1-(1-methylpiperidin-1-ium-4-yl)piperidin-1-ium-3-carboxamide Formula: C20H37N5O+2 MolecularWeight: 363.54068

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CCN(C)C(=O)C2CCC[NH+](C2)C3CC[NH+](CC3)C)C

Isomeric SMILES

CC1=CC(=NN1CCN(C)C(=O)[C@H]2CCC[NH+](C2)C3CC[NH+](CC3)C)C

InChI

InChI=1S/C20H35N5O/c1-16-14-17(2)25(21-16)13-12-23(4)20(26)18-6-5-9-24(15-18)19-7-10-22(3)11-8-19/h14,18-19H,5-13,15H2,1-4H3/p+2/t18-/m0/s1