[1-[(3-morpholin-4-ylsulfonylphenyl)amino]-1-oxidanylidene-propan-2-yl] 2-methylbutanoate

Systemtic Name: [1-[(3-morpholin-4-ylsulfonylphenyl)amino]-1-oxidanylidene-propan-2-yl] 2-methylbutanoate Openeye Name: [1-methyl-2-(3-morpholinosulfonylanilino)-2-oxo-ethyl] 2-methylbutanoate CAS Name: 2-methylbutanoic acid [1-[3-(4-morpholinylsulfonyl)anilino]-1-oxopropan-2-yl] ester IUPAC Name: [1-(3-morpholin-4-ylsulfonylanilino)-1-oxopropan-2-yl] 2-methylbutanoate Traditional Name: 2-methylbutyric acid [2-keto-1-methyl-2-(3-morpholinosulfonylanilino)ethyl] ester Formula: C18H26N2O6S MolecularWeight: 398.47384

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H26N2O6S/c1-4-13(2)18(22)26-14(3)17(21)19-15-6-5-7-16(12-15)27(23,24)20-8-10-25-11-9-20/h5-7,12-14H,4,8-11H2,1-3H3,(H,19,21)