(4-aminocarbonylacridin-9-yl)-[4-(heptylsulfonylamino)-2-methoxy-phenyl]azanium chloride

Systemtic Name: (4-aminocarbonylacridin-9-yl)-[4-(heptylsulfonylamino)-2-methoxy-phenyl]azanium chloride Openeye Name: (4-carbamoylacridin-9-yl)-[4-(heptylsulfonylamino)-2-methoxy-phenyl]ammonium chloride CAS Name: (4-carbamoyl-9-acridinyl)-[4-(heptylsulfonylamino)-2-methoxyphenyl]ammonium chloride IUPAC Name: (4-carbamoylacridin-9-yl)-[4-(heptylsulfonylamino)-2-methoxyphenyl]azanium chloride Traditional Name: (4-carbamoylacridin-9-yl)-[4-(heptylsulfonylamino)-2-methoxy-phenyl]ammonium chloride Formula: C28H33ClN4O4S MolecularWeight: 557.10402

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCS(=O)(=O)NC1=CC(=C(C=C1)[NH2+]C2=C3C=CC=C(C3=NC4=CC=CC=C42)C(=O)N)OC.[Cl-]

Isomeric SMILES

CCCCCCCS(=O)(=O)NC1=CC(=C(C=C1)[NH2+]C2=C3C=CC=C(C3=NC4=CC=CC=C42)C(=O)N)OC.[Cl-]

InChI

InChI=1S/C28H32N4O4S.ClH/c1-3-4-5-6-9-17-37(34,35)32-19-15-16-24(25(18-19)36-2)31-26-20-11-7-8-14-23(20)30-27-21(26)12-10-13-22(27)28(29)33;/h7-8,10-16,18,32H,3-6,9,17H2,1-2H3,(H2,29,33)(H,30,31);1H