2-[phenylsulfonyl-(2,4,6-trimethylphenyl)amino]ethanoic acid

Systemtic Name: 2-[phenylsulfonyl-(2,4,6-trimethylphenyl)amino]ethanoic acid Openeye Name: 2-[N-(benzenesulfonyl)-2,4,6-trimethyl-anilino]acetic acid CAS Name: 2-[N-(benzenesulfonyl)-2,4,6-trimethylanilino]acetic acid IUPAC Name: 2-[N-(benzenesulfonyl)-2,4,6-trimethylanilino]acetic acid Traditional Name: 2-(N-besyl-2,4,6-trimethyl-anilino)acetic acid Formula: C17H19NO4S MolecularWeight: 333.40206

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H19NO4S/c1-12-9-13(2)17(14(3)10-12)18(11-16(19)20)23(21,22)15-7-5-4-6-8-15/h4-10H,11H2,1-3H3,(H,19,20)