dimethyl 2-[(4-nitrophenyl)methyl]propanedioate

Systemtic Name: dimethyl 2-[(4-nitrophenyl)methyl]propanedioate Openeye Name: dimethyl 2-[(4-nitrophenyl)methyl]propanedioate CAS Name: 2-[(4-nitrophenyl)methyl]propanedioic acid dimethyl ester IUPAC Name: dimethyl 2-[(4-nitrophenyl)methyl]propanedioate Traditional Name: 2-(4-nitrobenzyl)malonic acid dimethyl ester Formula: C12H13NO6 MolecularWeight: 267.23472

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=C(C=C1)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

COC(=O)C(CC1=CC=C(C=C1)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C12H13NO6/c1-18-11(14)10(12(15)19-2)7-8-3-5-9(6-4-8)13(16)17/h3-6,10H,7H2,1-2H3