2-methyl-N-[[4-(2-methylpropoxy)phenyl]methyl]-1H-pyrazol-2-ium-3-amine

Systemtic Name: 2-methyl-N-[[4-(2-methylpropoxy)phenyl]methyl]-1H-pyrazol-2-ium-3-amine Openeye Name: N-[(4-isobutoxyphenyl)methyl]-2-methyl-1H-pyrazol-2-ium-3-amine CAS Name: 2-methyl-N-[[4-(2-methylpropoxy)phenyl]methyl]-1H-pyrazol-2-ium-3-amine IUPAC Name: 2-methyl-N-[[4-(2-methylpropoxy)phenyl]methyl]-1H-pyrazol-2-ium-3-amine Traditional Name: (4-isobutoxybenzyl)-(2-methyl-1H-pyrazol-2-ium-3-yl)amine Formula: C15H22N3O+ MolecularWeight: 260.35468

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=CC=C(C=C1)CNC2=[N+](NC=C2)C

Isomeric SMILES

CC(C)COC1=CC=C(C=C1)CNC2=[N+](NC=C2)C

InChI

InChI=1S/C15H21N3O/c1-12(2)11-19-14-6-4-13(5-7-14)10-16-15-8-9-17-18(15)3/h4-9,12H,10-11H2,1-3H3,(H,16,17)/p+1