(1-ethylpyrazol-3-yl)methyl-[[4-methoxy-3-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]azanium

Systemtic Name: (1-ethylpyrazol-3-yl)methyl-[[4-methoxy-3-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]azanium Openeye Name: (1-ethylpyrazol-3-yl)methyl-[[4-methoxy-3-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]ammonium CAS Name: (1-ethyl-3-pyrazolyl)methyl-[[4-methoxy-3-(1-pyrrolidin-1-iumylmethyl)phenyl]methyl]ammonium IUPAC Name: (1-ethylpyrazol-3-yl)methyl-[[4-methoxy-3-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]azanium Traditional Name: (1-ethylpyrazol-3-yl)methyl-[4-methoxy-3-(pyrrolidin-1-ium-1-ylmethyl)benzyl]ammonium Formula: C19H30N4O+2 MolecularWeight: 330.4677

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=CC(=N1)C[NH2+]CC2=CC(=C(C=C2)OC)C[NH+]3CCCC3

Isomeric SMILES

CCN1C=CC(=N1)C[NH2+]CC2=CC(=C(C=C2)OC)C[NH+]3CCCC3

InChI

InChI=1S/C19H28N4O/c1-3-23-11-8-18(21-23)14-20-13-16-6-7-19(24-2)17(12-16)15-22-9-4-5-10-22/h6-8,11-12,20H,3-5,9-10,13-15H2,1-2H3/p+2