2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-1-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]ethanone

Systemtic Name: 2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-1-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]ethanone Openeye Name: 1-[4-[(E)-cinnamyl]piperazin-1-yl]-2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)ethanone CAS Name: 2-(3,5-dimethyl-4-nitro-1-pyrazolyl)-1-[4-[(E)-3-phenylprop-2-enyl]-1-piperazinyl]ethanone IUPAC Name: 2-(3,5-dimethyl-4-nitropyrazol-1-yl)-1-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]ethanone Traditional Name: 1-[4-[(E)-cinnamyl]piperazino]-2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)ethanone Formula: C20H25N5O3 MolecularWeight: 383.4442

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(=O)N2CCN(CC2)CC=CC3=CC=CC=C3)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC(=O)N2CCN(CC2)C/C=C/C3=CC=CC=C3)C)[N+](=O)[O-]

InChI

InChI=1S/C20H25N5O3/c1-16-20(25(27)28)17(2)24(21-16)15-19(26)23-13-11-22(12-14-23)10-6-9-18-7-4-3-5-8-18/h3-9H,10-15H2,1-2H3/b9-6+