(4-methylphenyl)methyl-[(3-methyl-1-prop-2-enyl-pyrazol-4-yl)methyl]-(pyridin-4-ylmethyl)azanium

Systemtic Name: (4-methylphenyl)methyl-[(3-methyl-1-prop-2-enyl-pyrazol-4-yl)methyl]-(pyridin-4-ylmethyl)azanium Openeye Name: (1-allyl-3-methyl-pyrazol-4-yl)methyl-(p-tolylmethyl)-(4-pyridylmethyl)ammonium CAS Name: (4-methylphenyl)methyl-[(3-methyl-1-prop-2-enyl-4-pyrazolyl)methyl]-(pyridin-4-ylmethyl)ammonium IUPAC Name: (4-methylphenyl)methyl-[(3-methyl-1-prop-2-enylpyrazol-4-yl)methyl]-(pyridin-4-ylmethyl)azanium Traditional Name: (1-allyl-3-methyl-pyrazol-4-yl)methyl-(4-methylbenzyl)-(4-pyridylmethyl)ammonium Formula: C22H27N4+ MolecularWeight: 347.47658

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C[NH+](CC2=CC=NC=C2)CC3=CN(N=C3C)CC=C

Isomeric SMILES

CC1=CC=C(C=C1)C[NH+](CC2=CC=NC=C2)CC3=CN(N=C3C)CC=C

InChI

InChI=1S/C22H26N4/c1-4-13-26-17-22(19(3)24-26)16-25(15-21-9-11-23-12-10-21)14-20-7-5-18(2)6-8-20/h4-12,17H,1,13-16H2,2-3H3/p+1