phenacyl (2S)-3-methyl-2-[(4-nitrophenyl)sulfonylamino]butanoate

Systemtic Name: phenacyl (2S)-3-methyl-2-[(4-nitrophenyl)sulfonylamino]butanoate Openeye Name: phenacyl (2S)-3-methyl-2-[(4-nitrophenyl)sulfonylamino]butanoate CAS Name: (2S)-3-methyl-2-[(4-nitrophenyl)sulfonylamino]butanoic acid phenacyl ester IUPAC Name: phenacyl (2S)-3-methyl-2-[(4-nitrophenyl)sulfonylamino]butanoate Traditional Name: (2S)-3-methyl-2-(nosylamino)butyric acid phenacyl ester Formula: C19H20N2O7S MolecularWeight: 420.4363

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20N2O7S/c1-13(2)18(19(23)28-12-17(22)14-6-4-3-5-7-14)20-29(26,27)16-10-8-15(9-11-16)21(24)25/h3-11,13,18,20H,12H2,1-2H3/t18-/m0/s1