diethyl 2-[(2-bromophenyl)methyl]-2-(4-nitrophenyl)propanedioate

Systemtic Name: diethyl 2-[(2-bromophenyl)methyl]-2-(4-nitrophenyl)propanedioate Openeye Name: diethyl 2-[(2-bromophenyl)methyl]-2-(4-nitrophenyl)propanedioate CAS Name: 2-[(2-bromophenyl)methyl]-2-(4-nitrophenyl)propanedioic acid diethyl ester IUPAC Name: diethyl 2-[(2-bromophenyl)methyl]-2-(4-nitrophenyl)propanedioate Traditional Name: 2-(2-bromobenzyl)-2-(4-nitrophenyl)malonic acid diethyl ester Formula: C20H20BrNO6 MolecularWeight: 450.2799

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CC=CC=C1Br)(C2=CC=C(C=C2)[N+](=O)[O-])C(=O)OCC

Isomeric SMILES

CCOC(=O)C(CC1=CC=CC=C1Br)(C2=CC=C(C=C2)[N+](=O)[O-])C(=O)OCC

InChI

InChI=1S/C20H20BrNO6/c1-3-27-18(23)20(19(24)28-4-2,13-14-7-5-6-8-17(14)21)15-9-11-16(12-10-15)22(25)26/h5-12H,3-4,13H2,1-2H3