benzenesulfonate; 1-(1-phenylethyl)pyridin-1-ium

Systemtic Name: benzenesulfonate; 1-(1-phenylethyl)pyridin-1-ium Openeye Name: benzenesulfonate; 1-(1-phenylethyl)pyridin-1-ium CAS Name: benzenesulfonate; 1-(1-phenylethyl)pyridin-1-ium IUPAC Name: benzenesulfonate; 1-(1-phenylethyl)pyridin-1-ium Traditional Name: 1-(1-phenylethyl)pyridin-1-ium besylate Formula: C19H19NO3S MolecularWeight: 341.42406

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)[N+]2=CC=CC=C2.C1=CC=C(C=C1)S(=O)(=O)[O-]

Isomeric SMILES

CC(C1=CC=CC=C1)[N+]2=CC=CC=C2.C1=CC=C(C=C1)S(=O)(=O)[O-]

InChI

InChI=1S/C13H14N.C6H6O3S/c1-12(13-8-4-2-5-9-13)14-10-6-3-7-11-14;7-10(8,9)6-4-2-1-3-5-6/h2-12H,1H3;1-5H,(H,7,8,9)/q+1;/p-1