acridin-9-yl-[4-[4-(quinolin-4-ylazaniumyl)butylsulfonylamino]phenyl]azanium dibromide

Systemtic Name: acridin-9-yl-[4-[4-(quinolin-4-ylazaniumyl)butylsulfonylamino]phenyl]azanium dibromide Openeye Name: acridin-9-yl-[4-[4-(4-quinolylammonio)butylsulfonylamino]phenyl]ammonium dibromide CAS Name: 9-acridinyl-[4-[4-(4-quinolinylammonio)butylsulfonylamino]phenyl]ammonium dibromide IUPAC Name: acridin-9-yl-[4-[4-(quinolin-4-ylazaniumyl)butylsulfonylamino]phenyl]azanium dibromide Traditional Name: acridin-9-yl-[4-[4-(4-quinolylammonio)butylsulfonylamino]phenyl]ammonium dibromide Formula: C32H31Br2N5O2S MolecularWeight: 709.49384

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC=N2)[NH2+]CCCCS(=O)(=O)NC3=CC=C(C=C3)[NH2+]C4=C5C=CC=CC5=NC6=CC=CC=C64.[Br-].[Br-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC=N2)[NH2+]CCCCS(=O)(=O)NC3=CC=C(C=C3)[NH2+]C4=C5C=CC=CC5=NC6=CC=CC=C64.[Br-].[Br-]

InChI

InChI=1S/C32H29N5O2S.2BrH/c38-40(39,22-8-7-20-33-29-19-21-34-28-12-4-1-9-25(28)29)37-24-17-15-23(16-18-24)35-32-26-10-2-5-13-30(26)36-31-14-6-3-11-27(31)32;;/h1-6,9-19,21,37H,7-8,20,22H2,(H,33,34)(H,35,36);2*1H