3-(3,5-dimethylpyrazol-1-yl)-1-[4-(4-nitrophenyl)piperazin-1-yl]propan-1-one

Systemtic Name: 3-(3,5-dimethylpyrazol-1-yl)-1-[4-(4-nitrophenyl)piperazin-1-yl]propan-1-one Openeye Name: 3-(3,5-dimethylpyrazol-1-yl)-1-[4-(4-nitrophenyl)piperazin-1-yl]propan-1-one CAS Name: 3-(3,5-dimethyl-1-pyrazolyl)-1-[4-(4-nitrophenyl)-1-piperazinyl]-1-propanone IUPAC Name: 3-(3,5-dimethylpyrazol-1-yl)-1-[4-(4-nitrophenyl)piperazin-1-yl]propan-1-one Traditional Name: 3-(3,5-dimethylpyrazol-1-yl)-1-[4-(4-nitrophenyl)piperazino]propan-1-one Formula: C18H23N5O3 MolecularWeight: 357.40692

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CCC(=O)N2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=NN1CCC(=O)N2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-])C

InChI

InChI=1S/C18H23N5O3/c1-14-13-15(2)22(19-14)8-7-18(24)21-11-9-20(10-12-21)16-3-5-17(6-4-16)23(25)26/h3-6,13H,7-12H2,1-2H3