2-[4-(phenethylamino)phenyl]sulfonylethanoic acid

Systemtic Name: 2-[4-(phenethylamino)phenyl]sulfonylethanoic acid Openeye Name: 2-[4-(phenethylamino)phenyl]sulfonylacetic acid CAS Name: 2-[4-(phenethylamino)phenyl]sulfonylacetic acid IUPAC Name: 2-[4-(phenethylamino)phenyl]sulfonylacetic acid Traditional Name: 2-[4-(phenethylamino)phenyl]sulfonylacetic acid Formula: C16H17NO4S MolecularWeight: 319.37548

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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

Isomeric SMILES

C1=CC=C(C=C1)CCNC2=CC=C(C=C2)S(=O)(=O)CC(=O)O

InChI

InChI=1S/C16H17NO4S/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)