propan-2-yl 2-(4-nitrophenyl)sulfonylethanoate

Systemtic Name: propan-2-yl 2-(4-nitrophenyl)sulfonylethanoate Openeye Name: isopropyl 2-(4-nitrophenyl)sulfonylacetate CAS Name: 2-(4-nitrophenyl)sulfonylacetic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-(4-nitrophenyl)sulfonylacetate Traditional Name: 2-nosylacetic acid isopropyl ester Formula: C11H13NO6S MolecularWeight: 287.28902

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H13NO6S/c1-8(2)18-11(13)7-19(16,17)10-5-3-9(4-6-10)12(14)15/h3-6,8H,7H2,1-2H3