N-cyclohexyl-N-[(6-methoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]-4-nitro-benzenesulfonamide

Systemtic Name: N-cyclohexyl-N-[(6-methoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]-4-nitro-benzenesulfonamide Openeye Name: N-cyclohexyl-N-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-4-nitro-benzenesulfonamide CAS Name: N-cyclohexyl-N-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-4-nitrobenzenesulfonamide IUPAC Name: N-cyclohexyl-N-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-4-nitrobenzenesulfonamide Traditional Name: N-cyclohexyl-N-[(2-keto-6-methoxy-1H-quinolin-3-yl)methyl]-4-nitro-benzenesulfonamide Formula: C23H25N3O6S MolecularWeight: 471.5261

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)NC(=O)C(=C2)CN(C3CCCCC3)S(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

COC1=CC2=C(C=C1)NC(=O)C(=C2)CN(C3CCCCC3)S(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H25N3O6S/c1-32-20-9-12-22-16(14-20)13-17(23(27)24-22)15-25(18-5-3-2-4-6-18)33(30,31)21-10-7-19(8-11-21)26(28)29/h7-14,18H,2-6,15H2,1H3,(H,24,27)