sodium 3-pentoxybenzenesulfonate

Systemtic Name: sodium 3-pentoxybenzenesulfonate Openeye Name: sodium 3-pentoxybenzenesulfonate CAS Name: sodium 3-pentoxybenzenesulfonate IUPAC Name: sodium 3-pentoxybenzenesulfonate Traditional Name: sodium 3-amoxybesylate Formula: C11H15NaO4S MolecularWeight: 266.28917

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC(=CC=C1)S(=O)(=O)[O-].[Na+]

Isomeric SMILES

CCCCCOC1=CC(=CC=C1)S(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C11H16O4S.Na/c1-2-3-4-8-15-10-6-5-7-11(9-10)16(12,13)14;/h5-7,9H,2-4,8H2,1H3,(H,12,13,14);/q;+1/p-1