[2-[(2-methylsulfonylphenyl)amino]-2-oxidanylidene-ethyl] 4-methylpentanoate

Systemtic Name: [2-[(2-methylsulfonylphenyl)amino]-2-oxidanylidene-ethyl] 4-methylpentanoate Openeye Name: [2-(2-methylsulfonylanilino)-2-oxo-ethyl] 4-methylpentanoate CAS Name: 4-methylpentanoic acid [2-(2-methylsulfonylanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-methylsulfonylanilino)-2-oxoethyl] 4-methylpentanoate Traditional Name: 4-methylvaleric acid [2-keto-2-(2-mesylanilino)ethyl] ester Formula: C15H21NO5S MolecularWeight: 327.39594

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(=O)OCC(=O)NC1=CC=CC=C1S(=O)(=O)C

Isomeric SMILES

CC(C)CCC(=O)OCC(=O)NC1=CC=CC=C1S(=O)(=O)C

InChI

InChI=1S/C15H21NO5S/c1-11(2)8-9-15(18)21-10-14(17)16-12-6-4-5-7-13(12)22(3,19)20/h4-7,11H,8-10H2,1-3H3,(H,16,17)