[3,5-dimethyl-1-(phenylmethyl)pyrazol-4-yl]methyl-[(2-methoxyphenyl)methyl]azanium

Systemtic Name: [3,5-dimethyl-1-(phenylmethyl)pyrazol-4-yl]methyl-[(2-methoxyphenyl)methyl]azanium Openeye Name: (1-benzyl-3,5-dimethyl-pyrazol-4-yl)methyl-[(2-methoxyphenyl)methyl]ammonium CAS Name: [3,5-dimethyl-1-(phenylmethyl)-4-pyrazolyl]methyl-[(2-methoxyphenyl)methyl]ammonium IUPAC Name: (1-benzyl-3,5-dimethylpyrazol-4-yl)methyl-[(2-methoxyphenyl)methyl]azanium Traditional Name: (1-benzyl-3,5-dimethyl-pyrazol-4-yl)methyl-o-anisyl-ammonium Formula: C21H26N3O+ MolecularWeight: 336.45064

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=CC=C2)C)C[NH2+]CC3=CC=CC=C3OC

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=CC=C2)C)C[NH2+]CC3=CC=CC=C3OC

InChI

InChI=1S/C21H25N3O/c1-16-20(14-22-13-19-11-7-8-12-21(19)25-3)17(2)24(23-16)15-18-9-5-4-6-10-18/h4-12,22H,13-15H2,1-3H3/p+1