(4Z)-4-[1-[(4-methylpiperazin-1-yl)amino]ethylidene]-2-(4-nitrophenyl)-5-propyl-pyrazol-3-one

Systemtic Name: (4Z)-4-[1-[(4-methylpiperazin-1-yl)amino]ethylidene]-2-(4-nitrophenyl)-5-propyl-pyrazol-3-one Openeye Name: (4Z)-4-[1-[(4-methylpiperazin-1-yl)amino]ethylidene]-2-(4-nitrophenyl)-5-propyl-pyrazol-3-one CAS Name: (4Z)-4-[1-[(4-methyl-1-piperazinyl)amino]ethylidene]-2-(4-nitrophenyl)-5-propyl-3-pyrazolone IUPAC Name: (4Z)-4-[1-[(4-methylpiperazin-1-yl)amino]ethylidene]-2-(4-nitrophenyl)-5-propylpyrazol-3-one Traditional Name: (4Z)-4-[1-[(4-methylpiperazino)amino]ethylidene]-2-(4-nitrophenyl)-5-propyl-2-pyrazolin-3-one Formula: C19H26N6O3 MolecularWeight: 386.44814

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C(=O)C1=C(C)NN2CCN(CC2)C)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCCC\1=NN(C(=O)/C1=C(/C)\NN2CCN(CC2)C)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H26N6O3/c1-4-5-17-18(14(2)20-23-12-10-22(3)11-13-23)19(26)24(21-17)15-6-8-16(9-7-15)25(27)28/h6-9,20H,4-5,10-13H2,1-3H3/b18-14-