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

Systemtic Name: 3-azido-5-ethyl-6-phenyl-phenanthridin-5-ium-8-amine chloride Openeye Name: 3-azido-5-ethyl-6-phenyl-phenanthridin-5-ium-8-amine chloride CAS Name: 3-azido-5-ethyl-6-phenyl-8-phenanthridin-5-iumamine chloride IUPAC Name: 3-azido-5-ethyl-6-phenylphenanthridin-5-ium-8-amine chloride Traditional Name: (3-azido-5-ethyl-6-phenyl-phenanthridin-5-ium-8-yl)amine chloride Formula: C21H18ClN5 MolecularWeight: 375.85412

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H18N5.ClH/c1-2-26-20-13-16(24-25-23)9-11-18(20)17-10-8-15(22)12-19(17)21(26)14-6-4-3-5-7-14;/h3-13H,2,22H2,1H3;1H/q+1;/p-1