methyl (3R)-3-[methyl-(4-nitrophenyl)sulfonyl-amino]butanoate

Systemtic Name: methyl (3R)-3-[methyl-(4-nitrophenyl)sulfonyl-amino]butanoate Openeye Name: methyl (3R)-3-[methyl-(4-nitrophenyl)sulfonyl-amino]butanoate CAS Name: (3R)-3-[methyl-(4-nitrophenyl)sulfonylamino]butanoic acid methyl ester IUPAC Name: methyl (3R)-3-[methyl-(4-nitrophenyl)sulfonylamino]butanoate Traditional Name: (3R)-3-[methyl(nosyl)amino]butyric acid methyl ester Formula: C12H16N2O6S MolecularWeight: 316.33024

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H16N2O6S/c1-9(8-12(15)20-3)13(2)21(18,19)11-6-4-10(5-7-11)14(16)17/h4-7,9H,8H2,1-3H3/t9-/m1/s1