4-[(7-phenylbenzo[a]phenazin-7-ium-5-yl)amino]benzenesulfonic acid

Systemtic Name: 4-[(7-phenylbenzo[a]phenazin-7-ium-5-yl)amino]benzenesulfonic acid Openeye Name: 4-[(7-phenylbenzo[a]phenazin-7-ium-5-yl)amino]benzenesulfonic acid CAS Name: 4-[(7-phenyl-5-benzo[a]phenazin-7-iumyl)amino]benzenesulfonic acid IUPAC Name: 4-[(7-phenylbenzo[a]phenazin-7-ium-5-yl)amino]benzenesulfonic acid Traditional Name: 4-[(7-phenylbenzo[a]phenazin-7-ium-5-yl)amino]besylic acid Formula: C28H20N3O3S+ MolecularWeight: 478.5417

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)[N+]2=C3C=C(C4=CC=CC=C4C3=NC5=CC=CC=C52)NC6=CC=C(C=C6)S(=O)(=O)O

Isomeric SMILES

C1=CC=C(C=C1)[N+]2=C3C=C(C4=CC=CC=C4C3=NC5=CC=CC=C52)NC6=CC=C(C=C6)S(=O)(=O)O

InChI

InChI=1S/C28H19N3O3S/c32-35(33,34)21-16-14-19(15-17-21)29-25-18-27-28(23-11-5-4-10-22(23)25)30-24-12-6-7-13-26(24)31(27)20-8-2-1-3-9-20/h1-18H,(H,32,33,34)/p+1