2-[(4-methylphenyl)sulfonyl-phenyl-amino]ethanoic acid

Systemtic Name: 2-[(4-methylphenyl)sulfonyl-phenyl-amino]ethanoic acid Openeye Name: 2-[N-(p-tolylsulfonyl)anilino]acetic acid CAS Name: 2-(N-(4-methylphenyl)sulfonylanilino)acetic acid IUPAC Name: 2-(N-(4-methylphenyl)sulfonylanilino)acetic acid Traditional Name: 2-(N-tosylanilino)acetic acid Formula: C15H15NO4S MolecularWeight: 305.3489

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)O)C2=CC=CC=C2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)O)C2=CC=CC=C2

InChI

InChI=1S/C15H15NO4S/c1-12-7-9-14(10-8-12)21(19,20)16(11-15(17)18)13-5-3-2-4-6-13/h2-10H,11H2,1H3,(H,17,18)