[5-methyl-1-(4-methylphenyl)pyrazol-4-yl]-[4-(4-nitrophenyl)piperazin-1-yl]methanone

Systemtic Name: [5-methyl-1-(4-methylphenyl)pyrazol-4-yl]-[4-(4-nitrophenyl)piperazin-1-yl]methanone Openeye Name: [5-methyl-1-(p-tolyl)pyrazol-4-yl]-[4-(4-nitrophenyl)piperazin-1-yl]methanone CAS Name: [5-methyl-1-(4-methylphenyl)-4-pyrazolyl]-[4-(4-nitrophenyl)-1-piperazinyl]methanone IUPAC Name: [5-methyl-1-(4-methylphenyl)pyrazol-4-yl]-[4-(4-nitrophenyl)piperazin-1-yl]methanone Traditional Name: [5-methyl-1-(p-tolyl)pyrazol-4-yl]-[4-(4-nitrophenyl)piperazino]methanone Formula: C22H23N5O3 MolecularWeight: 405.44972

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=C(C=N2)C(=O)N3CCN(CC3)C4=CC=C(C=C4)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=C(C=N2)C(=O)N3CCN(CC3)C4=CC=C(C=C4)[N+](=O)[O-])C

InChI

InChI=1S/C22H23N5O3/c1-16-3-5-19(6-4-16)26-17(2)21(15-23-26)22(28)25-13-11-24(12-14-25)18-7-9-20(10-8-18)27(29)30/h3-10,15H,11-14H2,1-2H3