8-azido-5-ethyl-6-phenyl-phenanthridin-5-ium-3-amine iodide

Systemtic Name: 8-azido-5-ethyl-6-phenyl-phenanthridin-5-ium-3-amine iodide Openeye Name: 8-azido-5-ethyl-6-phenyl-phenanthridin-5-ium-3-amine iodide CAS Name: 8-azido-5-ethyl-6-phenyl-3-phenanthridin-5-iumamine iodide IUPAC Name: 8-azido-5-ethyl-6-phenylphenanthridin-5-ium-3-amine iodide Traditional Name: (8-azido-5-ethyl-6-phenyl-phenanthridin-5-ium-3-yl)amine iodide Formula: C21H18IN5 MolecularWeight: 467.30559

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H17N5.HI/c1-2-26-20-12-15(22)8-10-18(20)17-11-9-16(24-25-23)13-19(17)21(26)14-6-4-3-5-7-14;/h3-13,22H,2H2,1H3;1H