2-benzamido-2-[4-(4-sulfophenyl)phenyl]ethanoic acid

Systemtic Name: 2-benzamido-2-[4-(4-sulfophenyl)phenyl]ethanoic acid Openeye Name: 2-benzamido-2-[4-(4-sulfophenyl)phenyl]acetic acid CAS Name: 2-benzamido-2-[4-(4-sulfophenyl)phenyl]acetic acid IUPAC Name: 2-benzamido-2-[4-(4-sulfophenyl)phenyl]acetic acid Traditional Name: 2-benzamido-2-[4-(4-sulfophenyl)phenyl]acetic acid Formula: C21H17NO6S MolecularWeight: 411.42778

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC(C2=CC=C(C=C2)C3=CC=C(C=C3)S(=O)(=O)O)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NC(C2=CC=C(C=C2)C3=CC=C(C=C3)S(=O)(=O)O)C(=O)O

InChI

InChI=1S/C21H17NO6S/c23-20(17-4-2-1-3-5-17)22-19(21(24)25)16-8-6-14(7-9-16)15-10-12-18(13-11-15)29(26,27)28/h1-13,19H,(H,22,23)(H,24,25)(H,26,27,28)