N-[3-[4-(4-nitrophenyl)piperazin-1-yl]-3-oxidanylidene-propyl]-2-oxidanylidene-3,4-dihydro-1H-quinoline-6-sulfonamide

Systemtic Name: N-[3-[4-(4-nitrophenyl)piperazin-1-yl]-3-oxidanylidene-propyl]-2-oxidanylidene-3,4-dihydro-1H-quinoline-6-sulfonamide Openeye Name: N-[3-[4-(4-nitrophenyl)piperazin-1-yl]-3-oxo-propyl]-2-oxo-3,4-dihydro-1H-quinoline-6-sulfonamide CAS Name: N-[3-[4-(4-nitrophenyl)-1-piperazinyl]-3-oxopropyl]-2-oxo-3,4-dihydro-1H-quinoline-6-sulfonamide IUPAC Name: N-[3-[4-(4-nitrophenyl)piperazin-1-yl]-3-oxopropyl]-2-oxo-3,4-dihydro-1H-quinoline-6-sulfonamide Traditional Name: 2-keto-N-[3-keto-3-[4-(4-nitrophenyl)piperazino]propyl]-3,4-dihydro-1H-quinoline-6-sulfonamide Formula: C22H25N5O6S MolecularWeight: 487.5288

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)NC2=C1C=C(C=C2)S(=O)(=O)NCCC(=O)N3CCN(CC3)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1CC(=O)NC2=C1C=C(C=C2)S(=O)(=O)NCCC(=O)N3CCN(CC3)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H25N5O6S/c28-21-8-1-16-15-19(6-7-20(16)24-21)34(32,33)23-10-9-22(29)26-13-11-25(12-14-26)17-2-4-18(5-3-17)27(30)31/h2-7,15,23H,1,8-14H2,(H,24,28)