benzenesulfonate; trimethyl-(phenylmethyl)azanium

Systemtic Name: benzenesulfonate; trimethyl-(phenylmethyl)azanium Openeye Name: benzenesulfonate; benzyl(trimethyl)ammonium CAS Name: benzenesulfonate; trimethyl-(phenylmethyl)ammonium IUPAC Name: benzenesulfonate; benzyl(trimethyl)azanium Traditional Name: benzyl(trimethyl)ammonium besylate Formula: C16H21NO3S MolecularWeight: 307.40784

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CC1=CC=CC=C1.C1=CC=C(C=C1)S(=O)(=O)[O-]

Isomeric SMILES

C[N+](C)(C)CC1=CC=CC=C1.C1=CC=C(C=C1)S(=O)(=O)[O-]

InChI

InChI=1S/C10H16N.C6H6O3S/c1-11(2,3)9-10-7-5-4-6-8-10;7-10(8,9)6-4-2-1-3-5-6/h4-8H,9H2,1-3H3;1-5H,(H,7,8,9)/q+1;/p-1