N-[[4-methoxy-3-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]-1-methyl-pyrazol-4-amine

Systemtic Name: N-[[4-methoxy-3-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]-1-methyl-pyrazol-4-amine Openeye Name: N-[[4-methoxy-3-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]-1-methyl-pyrazol-4-amine CAS Name: N-[[4-methoxy-3-(1-pyrrolidin-1-iumylmethyl)phenyl]methyl]-1-methyl-4-pyrazolamine IUPAC Name: N-[[4-methoxy-3-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]-1-methylpyrazol-4-amine Traditional Name: [4-methoxy-3-(pyrrolidin-1-ium-1-ylmethyl)benzyl]-(1-methylpyrazol-4-yl)amine Formula: C17H25N4O+ MolecularWeight: 301.4066

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)NCC2=CC(=C(C=C2)OC)C[NH+]3CCCC3

Isomeric SMILES

CN1C=C(C=N1)NCC2=CC(=C(C=C2)OC)C[NH+]3CCCC3

InChI

InChI=1S/C17H24N4O/c1-20-13-16(11-19-20)18-10-14-5-6-17(22-2)15(9-14)12-21-7-3-4-8-21/h5-6,9,11,13,18H,3-4,7-8,10,12H2,1-2H3/p+1