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

Systemtic Name: N-[[3-(ethoxymethyl)-4-methoxy-phenyl]methyl]-2-methyl-1H-pyrazol-2-ium-3-amine Openeye Name: N-[[3-(ethoxymethyl)-4-methoxy-phenyl]methyl]-2-methyl-1H-pyrazol-2-ium-3-amine CAS Name: N-[[3-(ethoxymethyl)-4-methoxyphenyl]methyl]-2-methyl-1H-pyrazol-2-ium-3-amine IUPAC Name: N-[[3-(ethoxymethyl)-4-methoxyphenyl]methyl]-2-methyl-1H-pyrazol-2-ium-3-amine Traditional Name: [3-(ethoxymethyl)-4-methoxy-benzyl]-(2-methyl-1H-pyrazol-2-ium-3-yl)amine Formula: C15H22N3O2+ MolecularWeight: 276.35408

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Descriptors Computed from Structure

Canonical SMILES:

CCOCC1=C(C=CC(=C1)CNC2=[N+](NC=C2)C)OC

Isomeric SMILES

CCOCC1=C(C=CC(=C1)CNC2=[N+](NC=C2)C)OC

InChI

InChI=1S/C15H21N3O2/c1-4-20-11-13-9-12(5-6-14(13)19-3)10-16-15-7-8-17-18(15)2/h5-9H,4,10-11H2,1-3H3,(H,16,17)/p+1