[(1R)-1-(3-nitrophenyl)ethyl] (2R)-3-methyl-2-(thiophen-2-ylsulfonylamino)butanoate

Systemtic Name: [(1R)-1-(3-nitrophenyl)ethyl] (2R)-3-methyl-2-(thiophen-2-ylsulfonylamino)butanoate Openeye Name: [(1R)-1-(3-nitrophenyl)ethyl] (2R)-3-methyl-2-(2-thienylsulfonylamino)butanoate CAS Name: (2R)-3-methyl-2-(thiophen-2-ylsulfonylamino)butanoic acid [(1R)-1-(3-nitrophenyl)ethyl] ester IUPAC Name: [(1R)-1-(3-nitrophenyl)ethyl] (2R)-3-methyl-2-(thiophen-2-ylsulfonylamino)butanoate Traditional Name: (2R)-3-methyl-2-(2-thienylsulfonylamino)butyric acid [(1R)-1-(3-nitrophenyl)ethyl] ester Formula: C17H20N2O6S2 MolecularWeight: 412.4805

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OC(C)C1=CC(=CC=C1)[N+](=O)[O-])NS(=O)(=O)C2=CC=CS2

Isomeric SMILES

C[C@H](C1=CC(=CC=C1)[N+](=O)[O-])OC(=O)[C@@H](C(C)C)NS(=O)(=O)C2=CC=CS2

InChI

InChI=1S/C17H20N2O6S2/c1-11(2)16(18-27(23,24)15-8-5-9-26-15)17(20)25-12(3)13-6-4-7-14(10-13)19(21)22/h4-12,16,18H,1-3H3/t12-,16-/m1/s1