dimethyl 2-[(1S)-1-(4-acetyloxyphenyl)-2-nitro-ethyl]propanedioate

Systemtic Name: dimethyl 2-[(1S)-1-(4-acetyloxyphenyl)-2-nitro-ethyl]propanedioate Openeye Name: dimethyl 2-[(1S)-1-(4-acetoxyphenyl)-2-nitro-ethyl]propanedioate CAS Name: 2-[(1S)-1-(4-acetyloxyphenyl)-2-nitroethyl]propanedioic acid dimethyl ester IUPAC Name: dimethyl 2-[(1S)-1-(4-acetyloxyphenyl)-2-nitroethyl]propanedioate Traditional Name: 2-[(1S)-1-(4-acetoxyphenyl)-2-nitro-ethyl]malonic acid dimethyl ester Formula: C15H17NO8 MolecularWeight: 339.29738

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC=C(C=C1)C(C[N+](=O)[O-])C(C(=O)OC)C(=O)OC

Isomeric SMILES

CC(=O)OC1=CC=C(C=C1)[C@@H](C[N+](=O)[O-])C(C(=O)OC)C(=O)OC

InChI

InChI=1S/C15H17NO8/c1-9(17)24-11-6-4-10(5-7-11)12(8-16(20)21)13(14(18)22-2)15(19)23-3/h4-7,12-13H,8H2,1-3H3/t12-/m1/s1