ethyl (2S)-4-bromanyl-2-[(2-nitrophenyl)sulfonylamino]butanoate

Systemtic Name: ethyl (2S)-4-bromanyl-2-[(2-nitrophenyl)sulfonylamino]butanoate Openeye Name: ethyl (2S)-4-bromo-2-[(2-nitrophenyl)sulfonylamino]butanoate CAS Name: (2S)-4-bromo-2-[(2-nitrophenyl)sulfonylamino]butanoic acid ethyl ester IUPAC Name: ethyl (2S)-4-bromo-2-[(2-nitrophenyl)sulfonylamino]butanoate Traditional Name: (2S)-4-bromo-2-[(2-nitrophenyl)sulfonylamino]butyric acid ethyl ester Formula: C12H15BrN2O6S MolecularWeight: 395.2263

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCBr)NS(=O)(=O)C1=CC=CC=C1[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)[C@H](CCBr)NS(=O)(=O)C1=CC=CC=C1[N+](=O)[O-]

InChI

InChI=1S/C12H15BrN2O6S/c1-2-21-12(16)9(7-8-13)14-22(19,20)11-6-4-3-5-10(11)15(17)18/h3-6,9,14H,2,7-8H2,1H3/t9-/m0/s1