sodium 2-[2-azanyl-4-[2-(phenylsulfonylamino)ethyl]phenoxy]ethanoate

Systemtic Name: sodium 2-[2-azanyl-4-[2-(phenylsulfonylamino)ethyl]phenoxy]ethanoate Openeye Name: sodium 2-[2-amino-4-[2-(benzenesulfonamido)ethyl]phenoxy]acetate CAS Name: sodium 2-[2-amino-4-[2-(benzenesulfonamido)ethyl]phenoxy]acetate IUPAC Name: sodium 2-[2-amino-4-[2-(benzenesulfonamido)ethyl]phenoxy]acetate Traditional Name: sodium 2-[2-amino-4-[2-(benzenesulfonamido)ethyl]phenoxy]acetate Formula: C16H17N2NaO5S MolecularWeight: 372.37135

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)NCCC2=CC(=C(C=C2)OCC(=O)[O-])N.[Na+]

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)NCCC2=CC(=C(C=C2)OCC(=O)[O-])N.[Na+]

InChI

InChI=1S/C16H18N2O5S.Na/c17-14-10-12(6-7-15(14)23-11-16(19)20)8-9-18-24(21,22)13-4-2-1-3-5-13;/h1-7,10,18H,8-9,11,17H2,(H,19,20);/q;+1/p-1