N-[(1-methylpyrazol-4-yl)methyl]-3-pyrrolidin-1-ium-1-yl-propan-1-amine

Systemtic Name: N-[(1-methylpyrazol-4-yl)methyl]-3-pyrrolidin-1-ium-1-yl-propan-1-amine Openeye Name: N-[(1-methylpyrazol-4-yl)methyl]-3-pyrrolidin-1-ium-1-yl-propan-1-amine CAS Name: N-[(1-methyl-4-pyrazolyl)methyl]-3-(1-pyrrolidin-1-iumyl)-1-propanamine IUPAC Name: N-[(1-methylpyrazol-4-yl)methyl]-3-pyrrolidin-1-ium-1-ylpropan-1-amine Traditional Name: (1-methylpyrazol-4-yl)methyl-(3-pyrrolidin-1-ium-1-ylpropyl)amine Formula: C12H23N4+ MolecularWeight: 223.33782

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)CNCCC[NH+]2CCCC2

Isomeric SMILES

CN1C=C(C=N1)CNCCC[NH+]2CCCC2

InChI

InChI=1S/C12H22N4/c1-15-11-12(10-14-15)9-13-5-4-8-16-6-2-3-7-16/h10-11,13H,2-9H2,1H3/p+1