5-(dimethylaminomethyl)-4-ethyl-2-(phenylmethyl)-1H-pyrazol-2-ium-3-amine

Systemtic Name: 5-(dimethylaminomethyl)-4-ethyl-2-(phenylmethyl)-1H-pyrazol-2-ium-3-amine Openeye Name: 2-benzyl-5-(dimethylaminomethyl)-4-ethyl-1H-pyrazol-2-ium-3-amine CAS Name: 5-(dimethylaminomethyl)-4-ethyl-2-(phenylmethyl)-1H-pyrazol-2-ium-3-amine IUPAC Name: 2-benzyl-5-(dimethylaminomethyl)-4-ethyl-1H-pyrazol-2-ium-3-amine Traditional Name: (3-amino-2-benzyl-4-ethyl-1H-pyrazol-2-ium-5-yl)methyl-dimethyl-amine Formula: C15H23N4+ MolecularWeight: 259.36992

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N[N+](=C1N)CC2=CC=CC=C2)CN(C)C

Isomeric SMILES

CCC1=C(N[N+](=C1N)CC2=CC=CC=C2)CN(C)C

InChI

InChI=1S/C15H22N4/c1-4-13-14(11-18(2)3)17-19(15(13)16)10-12-8-6-5-7-9-12/h5-9H,4,10-11H2,1-3H3,(H2,16,17)/p+1