[3-(3-bromophenyl)-1-phenyl-pyrazol-4-yl]-piperidin-1-yl-methanone

Systemtic Name: [3-(3-bromophenyl)-1-phenyl-pyrazol-4-yl]-piperidin-1-yl-methanone Openeye Name: [3-(3-bromophenyl)-1-phenyl-pyrazol-4-yl]-(1-piperidyl)methanone CAS Name: [3-(3-bromophenyl)-1-phenyl-4-pyrazolyl]-(1-piperidinyl)methanone IUPAC Name: [3-(3-bromophenyl)-1-phenylpyrazol-4-yl]-piperidin-1-ylmethanone Traditional Name: [3-(3-bromophenyl)-1-phenyl-pyrazol-4-yl]-piperidino-methanone Formula: C21H20BrN3O MolecularWeight: 410.307

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C2=CN(N=C2C3=CC(=CC=C3)Br)C4=CC=CC=C4

Isomeric SMILES

C1CCN(CC1)C(=O)C2=CN(N=C2C3=CC(=CC=C3)Br)C4=CC=CC=C4

InChI

InChI=1S/C21H20BrN3O/c22-17-9-7-8-16(14-17)20-19(21(26)24-12-5-2-6-13-24)15-25(23-20)18-10-3-1-4-11-18/h1,3-4,7-11,14-15H,2,5-6,12-13H2