[5-methyl-1-(3-methylphenyl)pyrazol-4-yl]-[4-(4-nitrophenyl)piperazin-1-yl]methanone

Systemtic Name: [5-methyl-1-(3-methylphenyl)pyrazol-4-yl]-[4-(4-nitrophenyl)piperazin-1-yl]methanone Openeye Name: [5-methyl-1-(m-tolyl)pyrazol-4-yl]-[4-(4-nitrophenyl)piperazin-1-yl]methanone CAS Name: [5-methyl-1-(3-methylphenyl)-4-pyrazolyl]-[4-(4-nitrophenyl)-1-piperazinyl]methanone IUPAC Name: [5-methyl-1-(3-methylphenyl)pyrazol-4-yl]-[4-(4-nitrophenyl)piperazin-1-yl]methanone Traditional Name: [5-methyl-1-(m-tolyl)pyrazol-4-yl]-[4-(4-nitrophenyl)piperazino]methanone Formula: C22H23N5O3 MolecularWeight: 405.44972

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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