(E)-3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-1-[4-(6-nitropyridin-3-yl)piperazin-1-yl]prop-2-en-1-one

Systemtic Name: (E)-3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-1-[4-(6-nitropyridin-3-yl)piperazin-1-yl]prop-2-en-1-one Openeye Name: (E)-3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-1-[4-(6-nitro-3-pyridyl)piperazin-1-yl]prop-2-en-1-one CAS Name: (E)-3-(3,5-dimethyl-1-phenyl-4-pyrazolyl)-1-[4-(6-nitro-3-pyridinyl)-1-piperazinyl]-2-propen-1-one IUPAC Name: (E)-3-(3,5-dimethyl-1-phenylpyrazol-4-yl)-1-[4-(6-nitropyridin-3-yl)piperazin-1-yl]prop-2-en-1-one Traditional Name: (E)-3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-1-[4-(6-nitro-3-pyridyl)piperazino]prop-2-en-1-one Formula: C23H24N6O3 MolecularWeight: 432.47506

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H24N6O3/c1-17-21(18(2)28(25-17)19-6-4-3-5-7-19)9-11-23(30)27-14-12-26(13-15-27)20-8-10-22(24-16-20)29(31)32/h3-11,16H,12-15H2,1-2H3/b11-9+