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

Systemtic Name: 4-[4-(1H-imidazol-5-ylcarbonyl)piperazin-1-yl]-1-methyl-3-nitro-quinolin-2-one Openeye Name: 4-[4-(1H-imidazole-5-carbonyl)piperazin-1-yl]-1-methyl-3-nitro-quinolin-2-one CAS Name: 4-[4-[1H-imidazol-5-yl(oxo)methyl]-1-piperazinyl]-1-methyl-3-nitro-2-quinolinone IUPAC Name: 4-[4-(1H-imidazole-5-carbonyl)piperazin-1-yl]-1-methyl-3-nitroquinolin-2-one Traditional Name: 4-[4-(1H-imidazole-5-carbonyl)piperazino]-1-methyl-3-nitro-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=CN=CN4

Isomeric SMILES

CN1C2=CC=CC=C2C(=C(C1=O)[N+](=O)[O-])N3CCN(CC3)C(=O)C4=CN=CN4

InChI

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