[4-(butylsulfonylamino)-2-methoxy-phenyl]-(3-nitroacridin-9-yl)azanium chloride

Systemtic Name: [4-(butylsulfonylamino)-2-methoxy-phenyl]-(3-nitroacridin-9-yl)azanium chloride Openeye Name: [4-(butylsulfonylamino)-2-methoxy-phenyl]-(3-nitroacridin-9-yl)ammonium chloride CAS Name: [4-(butylsulfonylamino)-2-methoxyphenyl]-(3-nitro-9-acridinyl)ammonium chloride IUPAC Name: [4-(butylsulfonylamino)-2-methoxyphenyl]-(3-nitroacridin-9-yl)azanium chloride Traditional Name: [4-(butylsulfonylamino)-2-methoxy-phenyl]-(3-nitroacridin-9-yl)ammonium chloride Formula: C24H25ClN4O5S MolecularWeight: 516.9971

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)NC1=CC(=C(C=C1)[NH2+]C2=C3C=CC(=CC3=NC4=CC=CC=C42)[N+](=O)[O-])OC.[Cl-]

Isomeric SMILES

CCCCS(=O)(=O)NC1=CC(=C(C=C1)[NH2+]C2=C3C=CC(=CC3=NC4=CC=CC=C42)[N+](=O)[O-])OC.[Cl-]

InChI

InChI=1S/C24H24N4O5S.ClH/c1-3-4-13-34(31,32)27-16-9-12-21(23(14-16)33-2)26-24-18-7-5-6-8-20(18)25-22-15-17(28(29)30)10-11-19(22)24;/h5-12,14-15,27H,3-4,13H2,1-2H3,(H,25,26);1H