4-[(1,3-dimethylpyrazol-4-yl)methyl]-1-(4-methoxyphenyl)-6,6-dimethyl-piperazin-4-ium-2-one

Systemtic Name: 4-[(1,3-dimethylpyrazol-4-yl)methyl]-1-(4-methoxyphenyl)-6,6-dimethyl-piperazin-4-ium-2-one Openeye Name: 4-[(1,3-dimethylpyrazol-4-yl)methyl]-1-(4-methoxyphenyl)-6,6-dimethyl-piperazin-4-ium-2-one CAS Name: 4-[(1,3-dimethyl-4-pyrazolyl)methyl]-1-(4-methoxyphenyl)-6,6-dimethyl-2-piperazin-4-iumone IUPAC Name: 4-[(1,3-dimethylpyrazol-4-yl)methyl]-1-(4-methoxyphenyl)-6,6-dimethylpiperazin-4-ium-2-one Traditional Name: 4-[(1,3-dimethylpyrazol-4-yl)methyl]-1-(4-methoxyphenyl)-6,6-dimethyl-piperazin-4-ium-2-one Formula: C19H27N4O2+ MolecularWeight: 343.44328

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1C[NH+]2CC(=O)N(C(C2)(C)C)C3=CC=C(C=C3)OC)C

Isomeric SMILES

CC1=NN(C=C1C[NH+]2CC(=O)N(C(C2)(C)C)C3=CC=C(C=C3)OC)C

InChI

InChI=1S/C19H26N4O2/c1-14-15(10-21(4)20-14)11-22-12-18(24)23(19(2,3)13-22)16-6-8-17(25-5)9-7-16/h6-10H,11-13H2,1-5H3/p+1