N-cyclohexyl-N,1-dimethyl-3-[4-(4-nitrophenyl)piperazin-1-yl]carbonyl-4-oxidanylidene-quinoline-6-sulfonamide

Systemtic Name: N-cyclohexyl-N,1-dimethyl-3-[4-(4-nitrophenyl)piperazin-1-yl]carbonyl-4-oxidanylidene-quinoline-6-sulfonamide Openeye Name: N-cyclohexyl-N,1-dimethyl-3-[4-(4-nitrophenyl)piperazine-1-carbonyl]-4-oxo-quinoline-6-sulfonamide CAS Name: N-cyclohexyl-N,1-dimethyl-3-[[4-(4-nitrophenyl)-1-piperazinyl]-oxomethyl]-4-oxo-6-quinolinesulfonamide IUPAC Name: N-cyclohexyl-N,1-dimethyl-3-[4-(4-nitrophenyl)piperazine-1-carbonyl]-4-oxoquinoline-6-sulfonamide Traditional Name: N-cyclohexyl-4-keto-N,1-dimethyl-3-[4-(4-nitrophenyl)piperazine-1-carbonyl]quinoline-6-sulfonamide Formula: C28H33N5O6S MolecularWeight: 567.65652

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=O)C2=C1C=CC(=C2)S(=O)(=O)N(C)C3CCCCC3)C(=O)N4CCN(CC4)C5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

CN1C=C(C(=O)C2=C1C=CC(=C2)S(=O)(=O)N(C)C3CCCCC3)C(=O)N4CCN(CC4)C5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C28H33N5O6S/c1-29-19-25(28(35)32-16-14-31(15-17-32)21-8-10-22(11-9-21)33(36)37)27(34)24-18-23(12-13-26(24)29)40(38,39)30(2)20-6-4-3-5-7-20/h8-13,18-20H,3-7,14-17H2,1-2H3