N-[4-[3-[methyl-[(6-nitroquinolin-2-yl)methyl]amino]-2-oxidanyl-propoxy]phenyl]methanesulfonamide

Systemtic Name: N-[4-[3-[methyl-[(6-nitroquinolin-2-yl)methyl]amino]-2-oxidanyl-propoxy]phenyl]methanesulfonamide Openeye Name: N-[4-[2-hydroxy-3-[methyl-[(6-nitro-2-quinolyl)methyl]amino]propoxy]phenyl]methanesulfonamide CAS Name: N-[4-[2-hydroxy-3-[methyl-[(6-nitro-2-quinolinyl)methyl]amino]propoxy]phenyl]methanesulfonamide IUPAC Name: N-[4-[2-hydroxy-3-[methyl-[(6-nitroquinolin-2-yl)methyl]amino]propoxy]phenyl]methanesulfonamide Traditional Name: N-[4-[2-hydroxy-3-[methyl-[(6-nitro-2-quinolyl)methyl]amino]propoxy]phenyl]methanesulfonamide Formula: C21H24N4O6S MolecularWeight: 460.50346

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=NC2=C(C=C1)C=C(C=C2)[N+](=O)[O-])CC(COC3=CC=C(C=C3)NS(=O)(=O)C)O

Isomeric SMILES

CN(CC1=NC2=C(C=C1)C=C(C=C2)[N+](=O)[O-])CC(COC3=CC=C(C=C3)NS(=O)(=O)C)O

InChI

InChI=1S/C21H24N4O6S/c1-24(12-17-4-3-15-11-18(25(27)28)7-10-21(15)22-17)13-19(26)14-31-20-8-5-16(6-9-20)23-32(2,29)30/h3-11,19,23,26H,12-14H2,1-2H3