sodium 4-(butanoylamino)benzenesulfonate

Systemtic Name: sodium 4-(butanoylamino)benzenesulfonate Openeye Name: sodium 4-(butanoylamino)benzenesulfonate CAS Name: sodium 4-(1-oxobutylamino)benzenesulfonate IUPAC Name: sodium 4-(butanoylamino)benzenesulfonate Traditional Name: sodium 4-butyramidobesylate Formula: C10H12NNaO4S MolecularWeight: 265.26135

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=CC=C(C=C1)S(=O)(=O)[O-].[Na+]

Isomeric SMILES

CCCC(=O)NC1=CC=C(C=C1)S(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C10H13NO4S.Na/c1-2-3-10(12)11-8-4-6-9(7-5-8)16(13,14)15;/h4-7H,2-3H2,1H3,(H,11,12)(H,13,14,15);/q;+1/p-1