[4-(3,5-dimethylpyrazol-1-yl)phenyl]-[4-(2-nitrophenyl)piperazin-1-yl]methanone

Systemtic Name: [4-(3,5-dimethylpyrazol-1-yl)phenyl]-[4-(2-nitrophenyl)piperazin-1-yl]methanone Openeye Name: [4-(3,5-dimethylpyrazol-1-yl)phenyl]-[4-(2-nitrophenyl)piperazin-1-yl]methanone CAS Name: [4-(3,5-dimethyl-1-pyrazolyl)phenyl]-[4-(2-nitrophenyl)-1-piperazinyl]methanone IUPAC Name: [4-(3,5-dimethylpyrazol-1-yl)phenyl]-[4-(2-nitrophenyl)piperazin-1-yl]methanone Traditional Name: [4-(3,5-dimethylpyrazol-1-yl)phenyl]-[4-(2-nitrophenyl)piperazino]methanone Formula: C22H23N5O3 MolecularWeight: 405.44972

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=CC=C(C=C2)C(=O)N3CCN(CC3)C4=CC=CC=C4[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=NN1C2=CC=C(C=C2)C(=O)N3CCN(CC3)C4=CC=CC=C4[N+](=O)[O-])C

InChI

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