butyl 4-[2-[(3-methylsulfonylphenyl)amino]-2-oxidanylidene-ethoxy]benzoate

Systemtic Name: butyl 4-[2-[(3-methylsulfonylphenyl)amino]-2-oxidanylidene-ethoxy]benzoate Openeye Name: butyl 4-[2-(3-methylsulfonylanilino)-2-oxo-ethoxy]benzoate CAS Name: 4-[2-(3-methylsulfonylanilino)-2-oxoethoxy]benzoic acid butyl ester IUPAC Name: butyl 4-[2-(3-methylsulfonylanilino)-2-oxoethoxy]benzoate Traditional Name: 4-[2-keto-2-(3-mesylanilino)ethoxy]benzoic acid butyl ester Formula: C20H23NO6S MolecularWeight: 405.46472

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)OCC(=O)NC2=CC(=CC=C2)S(=O)(=O)C

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)OCC(=O)NC2=CC(=CC=C2)S(=O)(=O)C

InChI

InChI=1S/C20H23NO6S/c1-3-4-12-26-20(23)15-8-10-17(11-9-15)27-14-19(22)21-16-6-5-7-18(13-16)28(2,24)25/h5-11,13H,3-4,12,14H2,1-2H3,(H,21,22)