benzenesulfonate; tetrapropylazanium

Systemtic Name: benzenesulfonate; tetrapropylazanium Openeye Name: benzenesulfonate; tetrapropylammonium CAS Name: benzenesulfonate; tetrapropylammonium IUPAC Name: benzenesulfonate; tetrapropylazanium Traditional Name: tetrapropylammonium besylate Formula: C18H33NO3S MolecularWeight: 343.52452

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H28N.C6H6O3S/c1-5-9-13(10-6-2,11-7-3)12-8-4;7-10(8,9)6-4-2-1-3-5-6/h5-12H2,1-4H3;1-5H,(H,7,8,9)/q+1;/p-1