1-acridin-10-ium-10-ylpropane-1-sulfonic acid chloride

Systemtic Name: 1-acridin-10-ium-10-ylpropane-1-sulfonic acid chloride Openeye Name: 1-acridin-10-ium-10-ylpropane-1-sulfonic acid chloride CAS Name: 1-(10-acridin-10-iumyl)-1-propanesulfonic acid chloride IUPAC Name: 1-acridin-10-ium-10-ylpropane-1-sulfonic acid chloride Traditional Name: 1-acridin-10-ium-10-ylpropane-1-sulfonic acid chloride Formula: C16H16ClNO3S MolecularWeight: 337.82114

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Descriptors Computed from Structure

Canonical SMILES:

CCC([N+]1=C2C=CC=CC2=CC3=CC=CC=C31)S(=O)(=O)O.[Cl-]

Isomeric SMILES

CCC([N+]1=C2C=CC=CC2=CC3=CC=CC=C31)S(=O)(=O)O.[Cl-]

InChI

InChI=1S/C16H15NO3S.ClH/c1-2-16(21(18,19)20)17-14-9-5-3-7-12(14)11-13-8-4-6-10-15(13)17;/h3-11,16H,2H2,1H3;1H