[(2R)-1-[(4-morpholin-4-ylsulfonylphenyl)amino]-1-oxidanylidene-propan-2-yl] butanoate

Systemtic Name: [(2R)-1-[(4-morpholin-4-ylsulfonylphenyl)amino]-1-oxidanylidene-propan-2-yl] butanoate Openeye Name: [(1R)-1-methyl-2-(4-morpholinosulfonylanilino)-2-oxo-ethyl] butanoate CAS Name: butanoic acid [(2R)-1-[4-(4-morpholinylsulfonyl)anilino]-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(4-morpholin-4-ylsulfonylanilino)-1-oxopropan-2-yl] butanoate Traditional Name: butyric acid [(1R)-2-keto-1-methyl-2-(4-morpholinosulfonylanilino)ethyl] ester Formula: C17H24N2O6S MolecularWeight: 384.44726

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OC(C)C(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCOCC2

Isomeric SMILES

CCCC(=O)O[C@H](C)C(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCOCC2

InChI

InChI=1S/C17H24N2O6S/c1-3-4-16(20)25-13(2)17(21)18-14-5-7-15(8-6-14)26(22,23)19-9-11-24-12-10-19/h5-8,13H,3-4,9-12H2,1-2H3,(H,18,21)/t13-/m1/s1