5-pentyl-6-phenyl-phenanthridin-5-ium-3,8-diamine bromide

Systemtic Name: 5-pentyl-6-phenyl-phenanthridin-5-ium-3,8-diamine bromide Openeye Name: 5-pentyl-6-phenyl-phenanthridin-5-ium-3,8-diamine bromide CAS Name: 5-pentyl-6-phenylphenanthridin-5-ium-3,8-diamine bromide IUPAC Name: 5-pentyl-6-phenylphenanthridin-5-ium-3,8-diamine bromide Traditional Name: (3-amino-5-amyl-6-phenyl-phenanthridin-5-ium-8-yl)amine bromide Formula: C24H26BrN3 MolecularWeight: 436.38734

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC[N+]1=C2C=C(C=CC2=C3C=CC(=CC3=C1C4=CC=CC=C4)N)N.[Br-]

Isomeric SMILES

CCCCC[N+]1=C2C=C(C=CC2=C3C=CC(=CC3=C1C4=CC=CC=C4)N)N.[Br-]

InChI

InChI=1S/C24H25N3.BrH/c1-2-3-7-14-27-23-16-19(26)11-13-21(23)20-12-10-18(25)15-22(20)24(27)17-8-5-4-6-9-17;/h4-6,8-13,15-16,26H,2-3,7,14,25H2,1H3;1H