(3,5-dimethyl-1-propyl-pyrazol-4-yl)methyl-phenethyl-(pyridin-4-ylmethyl)azanium

Systemtic Name: (3,5-dimethyl-1-propyl-pyrazol-4-yl)methyl-phenethyl-(pyridin-4-ylmethyl)azanium Openeye Name: (3,5-dimethyl-1-propyl-pyrazol-4-yl)methyl-phenethyl-(4-pyridylmethyl)ammonium CAS Name: (3,5-dimethyl-1-propyl-4-pyrazolyl)methyl-phenethyl-(pyridin-4-ylmethyl)ammonium IUPAC Name: (3,5-dimethyl-1-propylpyrazol-4-yl)methyl-phenethyl-(pyridin-4-ylmethyl)azanium Traditional Name: (3,5-dimethyl-1-propyl-pyrazol-4-yl)methyl-phenethyl-(4-pyridylmethyl)ammonium Formula: C23H31N4+ MolecularWeight: 363.51904

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(C(=N1)C)C[NH+](CCC2=CC=CC=C2)CC3=CC=NC=C3)C

Isomeric SMILES

CCCN1C(=C(C(=N1)C)C[NH+](CCC2=CC=CC=C2)CC3=CC=NC=C3)C

InChI

InChI=1S/C23H30N4/c1-4-15-27-20(3)23(19(2)25-27)18-26(17-22-10-13-24-14-11-22)16-12-21-8-6-5-7-9-21/h5-11,13-14H,4,12,15-18H2,1-3H3/p+1