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

Systemtic Name: 1-ethyl-N-[[4-methoxy-3-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]pyrazol-4-amine Openeye Name: 1-ethyl-N-[[4-methoxy-3-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]pyrazol-4-amine CAS Name: 1-ethyl-N-[[4-methoxy-3-(1-pyrrolidin-1-iumylmethyl)phenyl]methyl]-4-pyrazolamine IUPAC Name: 1-ethyl-N-[[4-methoxy-3-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]pyrazol-4-amine Traditional Name: (1-ethylpyrazol-4-yl)-[4-methoxy-3-(pyrrolidin-1-ium-1-ylmethyl)benzyl]amine Formula: C18H27N4O+ MolecularWeight: 315.43318

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C=N1)NCC2=CC(=C(C=C2)OC)C[NH+]3CCCC3

Isomeric SMILES

CCN1C=C(C=N1)NCC2=CC(=C(C=C2)OC)C[NH+]3CCCC3

InChI

InChI=1S/C18H26N4O/c1-3-22-14-17(12-20-22)19-11-15-6-7-18(23-2)16(10-15)13-21-8-4-5-9-21/h6-7,10,12,14,19H,3-5,8-9,11,13H2,1-2H3/p+1