2,2-dimethyl-N-[2-[1-(1-propylpiperidin-1-ium-4-yl)piperidin-1-ium-4-yl]pyrazol-3-yl]propanamide

Systemtic Name: 2,2-dimethyl-N-[2-[1-(1-propylpiperidin-1-ium-4-yl)piperidin-1-ium-4-yl]pyrazol-3-yl]propanamide Openeye Name: 2,2-dimethyl-N-[2-[1-(1-propylpiperidin-1-ium-4-yl)piperidin-1-ium-4-yl]pyrazol-3-yl]propanamide CAS Name: 2,2-dimethyl-N-[2-[1-(1-propyl-4-piperidin-1-iumyl)-4-piperidin-1-iumyl]-3-pyrazolyl]propanamide IUPAC Name: 2,2-dimethyl-N-[2-[1-(1-propylpiperidin-1-ium-4-yl)piperidin-1-ium-4-yl]pyrazol-3-yl]propanamide Traditional Name: 2,2-dimethyl-N-[2-[1-(1-propylpiperidin-1-ium-4-yl)piperidin-1-ium-4-yl]pyrazol-3-yl]propionamide Formula: C21H39N5O+2 MolecularWeight: 377.56726

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CCC(CC1)[NH+]2CCC(CC2)N3C(=CC=N3)NC(=O)C(C)(C)C

Isomeric SMILES

CCC[NH+]1CCC(CC1)[NH+]2CCC(CC2)N3C(=CC=N3)NC(=O)C(C)(C)C

InChI

InChI=1S/C21H37N5O/c1-5-12-24-13-7-17(8-14-24)25-15-9-18(10-16-25)26-19(6-11-22-26)23-20(27)21(2,3)4/h6,11,17-18H,5,7-10,12-16H2,1-4H3,(H,23,27)/p+2