(2S)-2-[methyl-(4-nitrophenyl)sulfonyl-amino]-3-[(2-methylpropan-2-yl)oxy]propanoic acid

Systemtic Name: (2S)-2-[methyl-(4-nitrophenyl)sulfonyl-amino]-3-[(2-methylpropan-2-yl)oxy]propanoic acid Openeye Name: (2S)-3-tert-butoxy-2-[methyl-(4-nitrophenyl)sulfonyl-amino]propanoic acid CAS Name: (2S)-2-[methyl-(4-nitrophenyl)sulfonylamino]-3-[(2-methylpropan-2-yl)oxy]propanoic acid IUPAC Name: (2S)-2-[methyl-(4-nitrophenyl)sulfonylamino]-3-[(2-methylpropan-2-yl)oxy]propanoic acid Traditional Name: (2S)-3-tert-butoxy-2-[methyl(nosyl)amino]propionic acid Formula: C14H20N2O7S MolecularWeight: 360.3828

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OCC(C(=O)O)N(C)S(=O)(=O)C1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)OC[C@@H](C(=O)O)N(C)S(=O)(=O)C1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C14H20N2O7S/c1-14(2,3)23-9-12(13(17)18)15(4)24(21,22)11-7-5-10(6-8-11)16(19)20/h5-8,12H,9H2,1-4H3,(H,17,18)/t12-/m0/s1