dimethyl 2-[(1R,2R)-2-methanoyl-1-(4-nitrophenyl)pent-4-enyl]propanedioate

Systemtic Name: dimethyl 2-[(1R,2R)-2-methanoyl-1-(4-nitrophenyl)pent-4-enyl]propanedioate Openeye Name: dimethyl 2-[(1R,2R)-2-formyl-1-(4-nitrophenyl)pent-4-enyl]propanedioate CAS Name: 2-[(1R,2R)-2-formyl-1-(4-nitrophenyl)pent-4-enyl]propanedioic acid dimethyl ester IUPAC Name: dimethyl 2-[(1R,2R)-2-formyl-1-(4-nitrophenyl)pent-4-enyl]propanedioate Traditional Name: 2-[(1R,2R)-2-formyl-1-(4-nitrophenyl)pent-4-enyl]malonic acid dimethyl ester Formula: C17H19NO7 MolecularWeight: 349.33526

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H19NO7/c1-4-5-12(10-19)14(15(16(20)24-2)17(21)25-3)11-6-8-13(9-7-11)18(22)23/h4,6-10,12,14-15H,1,5H2,2-3H3/t12-,14+/m0/s1