sodium 3-(butylcarbamoylamino)benzenesulfonate

Systemtic Name: sodium 3-(butylcarbamoylamino)benzenesulfonate Openeye Name: sodium 3-(butylcarbamoylamino)benzenesulfonate CAS Name: sodium 3-[[butylamino(oxo)methyl]amino]benzenesulfonate IUPAC Name: sodium 3-(butylcarbamoylamino)benzenesulfonate Traditional Name: sodium 3-(butylcarbamoylamino)besylate Formula: C11H15N2NaO4S MolecularWeight: 294.30257

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H16N2O4S.Na/c1-2-3-7-12-11(14)13-9-5-4-6-10(8-9)18(15,16)17;/h4-6,8H,2-3,7H2,1H3,(H2,12,13,14)(H,15,16,17);/q;+1/p-1