sodium 6-azanyl-2-(phenylsulfonylamino)hexanoate

Systemtic Name: sodium 6-azanyl-2-(phenylsulfonylamino)hexanoate Openeye Name: sodium 6-amino-2-(benzenesulfonamido)hexanoate CAS Name: sodium 6-amino-2-(benzenesulfonamido)hexanoate IUPAC Name: sodium 6-amino-2-(benzenesulfonamido)hexanoate Traditional Name: sodium 6-amino-2-(benzenesulfonamido)hexanoate Formula: C12H17N2NaO4S MolecularWeight: 308.32915

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)NC(CCCCN)C(=O)[O-].[Na+]

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)NC(CCCCN)C(=O)[O-].[Na+]

InChI

InChI=1S/C12H18N2O4S.Na/c13-9-5-4-8-11(12(15)16)14-19(17,18)10-6-2-1-3-7-10;/h1-3,6-7,11,14H,4-5,8-9,13H2,(H,15,16);/q;+1/p-1