[4-[(3-fluoranyl-4-methoxy-phenyl)methyl]piperazin-1-yl]-(1-phenylpyrazol-4-yl)methanone

Systemtic Name: [4-[(3-fluoranyl-4-methoxy-phenyl)methyl]piperazin-1-yl]-(1-phenylpyrazol-4-yl)methanone Openeye Name: [4-[(3-fluoro-4-methoxy-phenyl)methyl]piperazin-1-yl]-(1-phenylpyrazol-4-yl)methanone CAS Name: [4-[(3-fluoro-4-methoxyphenyl)methyl]-1-piperazinyl]-(1-phenyl-4-pyrazolyl)methanone IUPAC Name: [4-[(3-fluoro-4-methoxyphenyl)methyl]piperazin-1-yl]-(1-phenylpyrazol-4-yl)methanone Traditional Name: [4-(3-fluoro-4-methoxy-benzyl)piperazino]-(1-phenylpyrazol-4-yl)methanone Formula: C22H23FN4O2 MolecularWeight: 394.442023

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN2CCN(CC2)C(=O)C3=CN(N=C3)C4=CC=CC=C4)F

Isomeric SMILES

COC1=C(C=C(C=C1)CN2CCN(CC2)C(=O)C3=CN(N=C3)C4=CC=CC=C4)F

InChI

InChI=1S/C22H23FN4O2/c1-29-21-8-7-17(13-20(21)23)15-25-9-11-26(12-10-25)22(28)18-14-24-27(16-18)19-5-3-2-4-6-19/h2-8,13-14,16H,9-12,15H2,1H3