N-cyclopropyl-3-[1-[(1-methyl-3-phenyl-pyrazol-4-yl)methyl]piperidin-1-ium-4-yl]propanamide

Systemtic Name: N-cyclopropyl-3-[1-[(1-methyl-3-phenyl-pyrazol-4-yl)methyl]piperidin-1-ium-4-yl]propanamide Openeye Name: N-cyclopropyl-3-[1-[(1-methyl-3-phenyl-pyrazol-4-yl)methyl]piperidin-1-ium-4-yl]propanamide CAS Name: N-cyclopropyl-3-[1-[(1-methyl-3-phenyl-4-pyrazolyl)methyl]-4-piperidin-1-iumyl]propanamide IUPAC Name: N-cyclopropyl-3-[1-[(1-methyl-3-phenylpyrazol-4-yl)methyl]piperidin-1-ium-4-yl]propanamide Traditional Name: N-cyclopropyl-3-[1-[(1-methyl-3-phenyl-pyrazol-4-yl)methyl]piperidin-1-ium-4-yl]propionamide Formula: C22H31N4O+ MolecularWeight: 367.50774

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=N1)C2=CC=CC=C2)C[NH+]3CCC(CC3)CCC(=O)NC4CC4

Isomeric SMILES

CN1C=C(C(=N1)C2=CC=CC=C2)C[NH+]3CCC(CC3)CCC(=O)NC4CC4

InChI

InChI=1S/C22H30N4O/c1-25-15-19(22(24-25)18-5-3-2-4-6-18)16-26-13-11-17(12-14-26)7-10-21(27)23-20-8-9-20/h2-6,15,17,20H,7-14,16H2,1H3,(H,23,27)/p+1