methyl 2-methyl-3-(4-nitrophenyl)-3-oxidanyl-propanoate

Systemtic Name: methyl 2-methyl-3-(4-nitrophenyl)-3-oxidanyl-propanoate Openeye Name: methyl 3-hydroxy-2-methyl-3-(4-nitrophenyl)propanoate CAS Name: 3-hydroxy-2-methyl-3-(4-nitrophenyl)propanoic acid methyl ester IUPAC Name: methyl 3-hydroxy-2-methyl-3-(4-nitrophenyl)propanoate Traditional Name: 3-hydroxy-2-methyl-3-(4-nitrophenyl)propionic acid methyl ester Formula: C11H13NO5 MolecularWeight: 239.22462

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H13NO5/c1-7(11(14)17-2)10(13)8-3-5-9(6-4-8)12(15)16/h3-7,10,13H,1-2H3