3-[4-[phenyl(phenylazanyl)methylidene]azaniumylphenoxy]propyl-di(propan-2-yl)azanium dibromide

Systemtic Name: 3-[4-[phenyl(phenylazanyl)methylidene]azaniumylphenoxy]propyl-di(propan-2-yl)azanium dibromide Openeye Name: 3-[4-[anilino(phenyl)methylene]ammoniophenoxy]propyl-diisopropyl-ammonium dibromide CAS Name: 3-[4-[anilino(phenyl)methylidene]ammoniophenoxy]propyl-di(propan-2-yl)ammonium dibromide IUPAC Name: 3-[4-[anilino(phenyl)methylidene]azaniumylphenoxy]propyl-di(propan-2-yl)azanium dibromide Traditional Name: 3-[4-[anilino(phenyl)methylene]ammoniophenoxy]propyl-diisopropyl-ammonium dibromide Formula: C28H37Br2N3O MolecularWeight: 591.42088

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+](CCCOC1=CC=C(C=C1)[NH+]=C(C2=CC=CC=C2)NC3=CC=CC=C3)C(C)C.[Br-].[Br-]

Isomeric SMILES

CC(C)[NH+](CCCOC1=CC=C(C=C1)/[NH+]=C(/C2=CC=CC=C2)\NC3=CC=CC=C3)C(C)C.[Br-].[Br-]

InChI

InChI=1S/C28H35N3O.2BrH/c1-22(2)31(23(3)4)20-11-21-32-27-18-16-26(17-19-27)30-28(24-12-7-5-8-13-24)29-25-14-9-6-10-15-25;;/h5-10,12-19,22-23H,11,20-21H2,1-4H3,(H,29,30);2*1H