[4-(3,5-dimethylpyrazol-1-yl)phenyl]-[(2R)-4-methyl-2-phenyl-piperazin-4-ium-1-yl]methanone

Systemtic Name: [4-(3,5-dimethylpyrazol-1-yl)phenyl]-[(2R)-4-methyl-2-phenyl-piperazin-4-ium-1-yl]methanone Openeye Name: [4-(3,5-dimethylpyrazol-1-yl)phenyl]-[(2R)-4-methyl-2-phenyl-piperazin-4-ium-1-yl]methanone CAS Name: [4-(3,5-dimethyl-1-pyrazolyl)phenyl]-[(2R)-4-methyl-2-phenyl-1-piperazin-4-iumyl]methanone IUPAC Name: [4-(3,5-dimethylpyrazol-1-yl)phenyl]-[(2R)-4-methyl-2-phenylpiperazin-4-ium-1-yl]methanone Traditional Name: [4-(3,5-dimethylpyrazol-1-yl)phenyl]-[(2R)-4-methyl-2-phenyl-piperazin-4-ium-1-yl]methanone Formula: C23H27N4O+ MolecularWeight: 375.48668

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=CC=C(C=C2)C(=O)N3CC[NH+](CC3C4=CC=CC=C4)C)C

Isomeric SMILES

CC1=CC(=NN1C2=CC=C(C=C2)C(=O)N3CC[NH+](C[C@H]3C4=CC=CC=C4)C)C

InChI

InChI=1S/C23H26N4O/c1-17-15-18(2)27(24-17)21-11-9-20(10-12-21)23(28)26-14-13-25(3)16-22(26)19-7-5-4-6-8-19/h4-12,15,22H,13-14,16H2,1-3H3/p+1/t22-/m0/s1