1-[6-(8-azanyl-6-phenyl-phenanthridin-5-ium-5-yl)hexyl]-5-methyl-pyrimidine-2,4-dione

Systemtic Name: 1-[6-(8-azanyl-6-phenyl-phenanthridin-5-ium-5-yl)hexyl]-5-methyl-pyrimidine-2,4-dione Openeye Name: 1-[6-(8-amino-6-phenyl-phenanthridin-5-ium-5-yl)hexyl]-5-methyl-pyrimidine-2,4-dione CAS Name: 1-[6-(8-amino-6-phenyl-5-phenanthridin-5-iumyl)hexyl]-5-methylpyrimidine-2,4-dione IUPAC Name: 1-[6-(8-amino-6-phenylphenanthridin-5-ium-5-yl)hexyl]-5-methylpyrimidine-2,4-dione Traditional Name: 1-[6-(8-amino-6-phenyl-phenanthridin-5-ium-5-yl)hexyl]-5-methyl-pyrimidine-2,4-quinone Formula: C30H31N4O2+ MolecularWeight: 479.59274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C(=O)NC1=O)CCCCCC[N+]2=C(C3=C(C=CC(=C3)N)C4=CC=CC=C42)C5=CC=CC=C5

Isomeric SMILES

CC1=CN(C(=O)NC1=O)CCCCCC[N+]2=C(C3=C(C=CC(=C3)N)C4=CC=CC=C42)C5=CC=CC=C5

InChI

InChI=1S/C30H30N4O2/c1-21-20-33(30(36)32-29(21)35)17-9-2-3-10-18-34-27-14-8-7-13-25(27)24-16-15-23(31)19-26(24)28(34)22-11-5-4-6-12-22/h4-8,11-16,19-20H,2-3,9-10,17-18,31H2,1H3/p+1