tert-butyl 3-[(4-methoxyphenyl)sulfonyl-[1-(methylamino)-3-oxidanyl-1-oxidanylidene-butan-2-yl]amino]propanoate

Systemtic Name: tert-butyl 3-[(4-methoxyphenyl)sulfonyl-[1-(methylamino)-3-oxidanyl-1-oxidanylidene-butan-2-yl]amino]propanoate Openeye Name: tert-butyl 3-[[2-hydroxy-1-(methylcarbamoyl)propyl]-(4-methoxyphenyl)sulfonyl-amino]propanoate CAS Name: 3-[[3-hydroxy-1-(methylamino)-1-oxobutan-2-yl]-(4-methoxyphenyl)sulfonylamino]propanoic acid tert-butyl ester IUPAC Name: tert-butyl 3-[[3-hydroxy-1-(methylamino)-1-oxobutan-2-yl]-(4-methoxyphenyl)sulfonylamino]propanoate Traditional Name: 3-[[2-hydroxy-1-(methylcarbamoyl)propyl]-(4-methoxyphenyl)sulfonyl-amino]propionic acid tert-butyl ester Formula: C19H30N2O7S MolecularWeight: 430.5157

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(=O)NC)N(CCC(=O)OC(C)(C)C)S(=O)(=O)C1=CC=C(C=C1)OC)O

Isomeric SMILES

CC(C(C(=O)NC)N(CCC(=O)OC(C)(C)C)S(=O)(=O)C1=CC=C(C=C1)OC)O

InChI

InChI=1S/C19H30N2O7S/c1-13(22)17(18(24)20-5)21(12-11-16(23)28-19(2,3)4)29(25,26)15-9-7-14(27-6)8-10-15/h7-10,13,17,22H,11-12H2,1-6H3,(H,20,24)