sodium 2-[4-(phenethylamino)phenyl]sulfonylethanoate

Systemtic Name: sodium 2-[4-(phenethylamino)phenyl]sulfonylethanoate Openeye Name: sodium 2-[4-(phenethylamino)phenyl]sulfonylacetate CAS Name: sodium 2-[4-(phenethylamino)phenyl]sulfonylacetate IUPAC Name: sodium 2-[4-(phenethylamino)phenyl]sulfonylacetate Traditional Name: sodium 2-[4-(phenethylamino)phenyl]sulfonylacetate Formula: C16H16NNaO4S MolecularWeight: 341.35731

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC2=CC=C(C=C2)S(=O)(=O)CC(=O)[O-].[Na+]

Isomeric SMILES

C1=CC=C(C=C1)CCNC2=CC=C(C=C2)S(=O)(=O)CC(=O)[O-].[Na+]

InChI

InChI=1S/C16H17NO4S.Na/c18-16(19)12-22(20,21)15-8-6-14(7-9-15)17-11-10-13-4-2-1-3-5-13;/h1-9,17H,10-12H2,(H,18,19);/q;+1/p-1