2-[phenylsulfonyl-(4-propan-2-ylphenyl)amino]ethanoate

Systemtic Name: 2-[phenylsulfonyl-(4-propan-2-ylphenyl)amino]ethanoate Openeye Name: 2-[N-(benzenesulfonyl)-4-isopropyl-anilino]acetate CAS Name: 2-[N-(benzenesulfonyl)-4-propan-2-ylanilino]acetate IUPAC Name: 2-[N-(benzenesulfonyl)-4-propan-2-ylanilino]acetate Traditional Name: 2-(N-besyl-4-isopropyl-anilino)acetate Formula: C17H18NO4S- MolecularWeight: 332.39412

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)N(CC(=O)[O-])S(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CC(C)C1=CC=C(C=C1)N(CC(=O)[O-])S(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C17H19NO4S/c1-13(2)14-8-10-15(11-9-14)18(12-17(19)20)23(21,22)16-6-4-3-5-7-16/h3-11,13H,12H2,1-2H3,(H,19,20)/p-1