(E)-3-(4-chlorophenyl)-1-[4-[3-(3,5-dimethylpyrazol-1-yl)-4-nitro-phenyl]piperazin-1-yl]prop-2-en-1-one

Systemtic Name: (E)-3-(4-chlorophenyl)-1-[4-[3-(3,5-dimethylpyrazol-1-yl)-4-nitro-phenyl]piperazin-1-yl]prop-2-en-1-one Openeye Name: (E)-3-(4-chlorophenyl)-1-[4-[3-(3,5-dimethylpyrazol-1-yl)-4-nitro-phenyl]piperazin-1-yl]prop-2-en-1-one CAS Name: (E)-3-(4-chlorophenyl)-1-[4-[3-(3,5-dimethyl-1-pyrazolyl)-4-nitrophenyl]-1-piperazinyl]-2-propen-1-one IUPAC Name: (E)-3-(4-chlorophenyl)-1-[4-[3-(3,5-dimethylpyrazol-1-yl)-4-nitrophenyl]piperazin-1-yl]prop-2-en-1-one Traditional Name: (E)-3-(4-chlorophenyl)-1-[4-[3-(3,5-dimethylpyrazol-1-yl)-4-nitro-phenyl]piperazino]prop-2-en-1-one Formula: C24H24ClN5O3 MolecularWeight: 465.93206

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=C(C=CC(=C2)N3CCN(CC3)C(=O)C=CC4=CC=C(C=C4)Cl)[N+](=O)[O-])C

Isomeric SMILES

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

InChI

InChI=1S/C24H24ClN5O3/c1-17-15-18(2)29(26-17)23-16-21(8-9-22(23)30(32)33)27-11-13-28(14-12-27)24(31)10-5-19-3-6-20(25)7-4-19/h3-10,15-16H,11-14H2,1-2H3/b10-5+