2-[4-[(1-ethyl-5-methyl-pyrazol-4-yl)methyl]piperazin-1-yl]pyridin-1-ium-3-amine

Systemtic Name: 2-[4-[(1-ethyl-5-methyl-pyrazol-4-yl)methyl]piperazin-1-yl]pyridin-1-ium-3-amine Openeye Name: 2-[4-[(1-ethyl-5-methyl-pyrazol-4-yl)methyl]piperazin-1-yl]pyridin-1-ium-3-amine CAS Name: 2-[4-[(1-ethyl-5-methyl-4-pyrazolyl)methyl]-1-piperazinyl]-3-pyridin-1-iumamine IUPAC Name: 2-[4-[(1-ethyl-5-methylpyrazol-4-yl)methyl]piperazin-1-yl]pyridin-1-ium-3-amine Traditional Name: [2-[4-[(1-ethyl-5-methyl-pyrazol-4-yl)methyl]piperazino]pyridin-1-ium-3-yl]amine Formula: C16H25N6+ MolecularWeight: 301.4099

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C=N1)CN2CCN(CC2)C3=C(C=CC=[NH+]3)N)C

Isomeric SMILES

CCN1C(=C(C=N1)CN2CCN(CC2)C3=C(C=CC=[NH+]3)N)C

InChI

InChI=1S/C16H24N6/c1-3-22-13(2)14(11-19-22)12-20-7-9-21(10-8-20)16-15(17)5-4-6-18-16/h4-6,11H,3,7-10,12,17H2,1-2H3/p+1