1-[4-[4-(5-nitroquinolin-8-yl)piperazin-1-yl]sulfonylphenyl]ethanone

Systemtic Name: 1-[4-[4-(5-nitroquinolin-8-yl)piperazin-1-yl]sulfonylphenyl]ethanone Openeye Name: 1-[4-[4-(5-nitro-8-quinolyl)piperazin-1-yl]sulfonylphenyl]ethanone CAS Name: 1-[4-[[4-(5-nitro-8-quinolinyl)-1-piperazinyl]sulfonyl]phenyl]ethanone IUPAC Name: 1-[4-[4-(5-nitroquinolin-8-yl)piperazin-1-yl]sulfonylphenyl]ethanone Traditional Name: 1-[4-[4-(5-nitro-8-quinolyl)piperazino]sulfonylphenyl]ethanone Formula: C21H20N4O5S MolecularWeight: 440.4723

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=C4C(=C(C=C3)[N+](=O)[O-])C=CC=N4

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=C4C(=C(C=C3)[N+](=O)[O-])C=CC=N4

InChI

InChI=1S/C21H20N4O5S/c1-15(26)16-4-6-17(7-5-16)31(29,30)24-13-11-23(12-14-24)20-9-8-19(25(27)28)18-3-2-10-22-21(18)20/h2-10H,11-14H2,1H3