3-phenazin-5-ium-5-ylpropane-1-sulfonate

Systemtic Name: 3-phenazin-5-ium-5-ylpropane-1-sulfonate Openeye Name: 3-phenazin-5-ium-5-ylpropane-1-sulfonate CAS Name: 3-(5-phenazin-5-iumyl)-1-propanesulfonate IUPAC Name: 3-phenazin-5-ium-5-ylpropane-1-sulfonate Traditional Name: 3-phenazin-5-ium-5-ylpropane-1-sulfonate Formula: C15H14N2O3S MolecularWeight: 302.34826

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C3C=CC=CC3=[N+]2CCCS(=O)(=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)N=C3C=CC=CC3=[N+]2CCCS(=O)(=O)[O-]

InChI

InChI=1S/C15H14N2O3S/c18-21(19,20)11-5-10-17-14-8-3-1-6-12(14)16-13-7-2-4-9-15(13)17/h1-4,6-9H,5,10-11H2