diethyl 2,2-bis[(2-nitrophenyl)methyl]propanedioate

Systemtic Name: diethyl 2,2-bis[(2-nitrophenyl)methyl]propanedioate Openeye Name: diethyl 2,2-bis[(2-nitrophenyl)methyl]propanedioate CAS Name: 2,2-bis[(2-nitrophenyl)methyl]propanedioic acid diethyl ester IUPAC Name: diethyl 2,2-bis[(2-nitrophenyl)methyl]propanedioate Traditional Name: 2,2-bis(2-nitrobenzyl)malonic acid diethyl ester Formula: C21H22N2O8 MolecularWeight: 430.40798

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CC=CC=C1[N+](=O)[O-])(CC2=CC=CC=C2[N+](=O)[O-])C(=O)OCC

Isomeric SMILES

CCOC(=O)C(CC1=CC=CC=C1[N+](=O)[O-])(CC2=CC=CC=C2[N+](=O)[O-])C(=O)OCC

InChI

InChI=1S/C21H22N2O8/c1-3-30-19(24)21(20(25)31-4-2,13-15-9-5-7-11-17(15)22(26)27)14-16-10-6-8-12-18(16)23(28)29/h5-12H,3-4,13-14H2,1-2H3