N-[3-(3,8-diazido-6-phenyl-phenanthridin-5-ium-5-yl)propyl]pentan-3-amine

Systemtic Name: N-[3-(3,8-diazido-6-phenyl-phenanthridin-5-ium-5-yl)propyl]pentan-3-amine Openeye Name: N-[3-(3,8-diazido-6-phenyl-phenanthridin-5-ium-5-yl)propyl]pentan-3-amine CAS Name: N-[3-(3,8-diazido-6-phenyl-5-phenanthridin-5-iumyl)propyl]-3-pentanamine IUPAC Name: N-[3-(3,8-diazido-6-phenylphenanthridin-5-ium-5-yl)propyl]pentan-3-amine Traditional Name: 3-(3,8-diazido-6-phenyl-phenanthridin-5-ium-5-yl)propyl-(1-ethylpropyl)amine Formula: C27H29N8+ MolecularWeight: 465.57276

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H29N8/c1-3-20(4-2)30-15-8-16-35-26-18-22(32-34-29)12-14-24(26)23-13-11-21(31-33-28)17-25(23)27(35)19-9-6-5-7-10-19/h5-7,9-14,17-18,20,30H,3-4,8,15-16H2,1-2H3/q+1