1-methyl-3-nitro-4-[4-(1H-pyrazol-5-ylcarbonyl)piperazin-1-yl]quinolin-2-one

Systemtic Name: 1-methyl-3-nitro-4-[4-(1H-pyrazol-5-ylcarbonyl)piperazin-1-yl]quinolin-2-one Openeye Name: 1-methyl-3-nitro-4-[4-(1H-pyrazole-5-carbonyl)piperazin-1-yl]quinolin-2-one CAS Name: 1-methyl-3-nitro-4-[4-[oxo(1H-pyrazol-5-yl)methyl]-1-piperazinyl]-2-quinolinone IUPAC Name: 1-methyl-3-nitro-4-[4-(1H-pyrazole-5-carbonyl)piperazin-1-yl]quinolin-2-one Traditional Name: 1-methyl-3-nitro-4-[4-(1H-pyrazole-5-carbonyl)piperazino]carbostyril Formula: C18H18N6O4 MolecularWeight: 382.37332

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=C(C1=O)[N+](=O)[O-])N3CCN(CC3)C(=O)C4=CC=NN4

Isomeric SMILES

CN1C2=CC=CC=C2C(=C(C1=O)[N+](=O)[O-])N3CCN(CC3)C(=O)C4=CC=NN4

InChI

InChI=1S/C18H18N6O4/c1-21-14-5-3-2-4-12(14)15(16(18(21)26)24(27)28)22-8-10-23(11-9-22)17(25)13-6-7-19-20-13/h2-7H,8-11H2,1H3,(H,19,20)