[4-ethoxy-1-(4-fluorophenyl)pyrazol-3-yl]-(4-methylpiperazin-4-ium-1-yl)methanone

Systemtic Name: [4-ethoxy-1-(4-fluorophenyl)pyrazol-3-yl]-(4-methylpiperazin-4-ium-1-yl)methanone Openeye Name: [4-ethoxy-1-(4-fluorophenyl)pyrazol-3-yl]-(4-methylpiperazin-4-ium-1-yl)methanone CAS Name: [4-ethoxy-1-(4-fluorophenyl)-3-pyrazolyl]-(4-methyl-1-piperazin-4-iumyl)methanone IUPAC Name: [4-ethoxy-1-(4-fluorophenyl)pyrazol-3-yl]-(4-methylpiperazin-4-ium-1-yl)methanone Traditional Name: [4-ethoxy-1-(4-fluorophenyl)pyrazol-3-yl]-(4-methylpiperazin-4-ium-1-yl)methanone Formula: C17H22FN4O2+ MolecularWeight: 333.380583

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CN(N=C1C(=O)N2CC[NH+](CC2)C)C3=CC=C(C=C3)F

Isomeric SMILES

CCOC1=CN(N=C1C(=O)N2CC[NH+](CC2)C)C3=CC=C(C=C3)F

InChI

InChI=1S/C17H21FN4O2/c1-3-24-15-12-22(14-6-4-13(18)5-7-14)19-16(15)17(23)21-10-8-20(2)9-11-21/h4-7,12H,3,8-11H2,1-2H3/p+1