4-chloranylbenzenesulfonate; pyridin-1-ium

Systemtic Name: 4-chloranylbenzenesulfonate; pyridin-1-ium Openeye Name: 4-chlorobenzenesulfonate; pyridin-1-ium CAS Name: 4-chlorobenzenesulfonate; pyridin-1-ium IUPAC Name: 4-chlorobenzenesulfonate; pyridin-1-ium Traditional Name: 4-chlorobesylate; pyridin-1-ium Formula: C17H14Cl2NO6S2- MolecularWeight: 463.33216

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[NH+]C=C1.C1=CC(=CC=C1S(=O)(=O)[O-])Cl.C1=CC(=CC=C1S(=O)(=O)[O-])Cl

Isomeric SMILES

C1=CC=[NH+]C=C1.C1=CC(=CC=C1S(=O)(=O)[O-])Cl.C1=CC(=CC=C1S(=O)(=O)[O-])Cl

InChI

InChI=1S/2C6H5ClO3S.C5H5N/c2*7-5-1-3-6(4-2-5)11(8,9)10;1-2-4-6-5-3-1/h2*1-4H,(H,8,9,10);1-5H/p-1