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

Systemtic Name: (3S)-N-[2-(3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-N-methyl-1-(1-methylpiperidin-1-ium-4-yl)piperidin-1-ium-3-carboxamide Openeye Name: (3S)-N-[2-(3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-N-methyl-1-(1-methylpiperidin-1-ium-4-yl)piperidin-1-ium-3-carboxamide CAS Name: (3S)-N-[2-(3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-N-methyl-1-(1-methyl-4-piperidin-1-iumyl)-3-piperidin-1-iumcarboxamide IUPAC Name: (3S)-N-[2-(3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-N-methyl-1-(1-methylpiperidin-1-ium-4-yl)piperidin-1-ium-3-carboxamide Traditional Name: (3S)-N-[2-(3,5-dimethyl-1H-pyrazol-4-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=C(C(=NN1)C)CCN(C)C(=O)C2CCC[NH+](C2)C3CC[NH+](CC3)C

Isomeric SMILES

CC1=C(C(=NN1)C)CCN(C)C(=O)[C@H]2CCC[NH+](C2)C3CC[NH+](CC3)C

InChI

InChI=1S/C20H35N5O/c1-15-19(16(2)22-21-15)9-13-24(4)20(26)17-6-5-10-25(14-17)18-7-11-23(3)12-8-18/h17-18H,5-14H2,1-4H3,(H,21,22)/p+2/t17-/m0/s1