N-methyl-1-[1-(3-phenylpropyl)piperidin-1-ium-4-yl]-N-(1H-pyrazol-5-ylmethyl)piperidine-4-carboxamide

Systemtic Name: N-methyl-1-[1-(3-phenylpropyl)piperidin-1-ium-4-yl]-N-(1H-pyrazol-5-ylmethyl)piperidine-4-carboxamide Openeye Name: N-methyl-1-[1-(3-phenylpropyl)piperidin-1-ium-4-yl]-N-(1H-pyrazol-5-ylmethyl)piperidine-4-carboxamide CAS Name: N-methyl-1-[1-(3-phenylpropyl)-4-piperidin-1-iumyl]-N-(1H-pyrazol-5-ylmethyl)-4-piperidinecarboxamide IUPAC Name: N-methyl-1-[1-(3-phenylpropyl)piperidin-1-ium-4-yl]-N-(1H-pyrazol-5-ylmethyl)piperidine-4-carboxamide Traditional Name: N-methyl-1-[1-(3-phenylpropyl)piperidin-1-ium-4-yl]-N-(1H-pyrazol-5-ylmethyl)isonipecotamide Formula: C25H38N5O+ MolecularWeight: 424.60212

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=NN1)C(=O)C2CCN(CC2)C3CC[NH+](CC3)CCCC4=CC=CC=C4

Isomeric SMILES

CN(CC1=CC=NN1)C(=O)C2CCN(CC2)C3CC[NH+](CC3)CCCC4=CC=CC=C4

InChI

InChI=1S/C25H37N5O/c1-28(20-23-9-14-26-27-23)25(31)22-10-18-30(19-11-22)24-12-16-29(17-13-24)15-5-8-21-6-3-2-4-7-21/h2-4,6-7,9,14,22,24H,5,8,10-13,15-20H2,1H3,(H,26,27)/p+1