bis(phenylmethyl) 2-(2-nitroethyl)pentanedioate

Systemtic Name: bis(phenylmethyl) 2-(2-nitroethyl)pentanedioate Openeye Name: dibenzyl 2-(2-nitroethyl)pentanedioate CAS Name: 2-(2-nitroethyl)pentanedioic acid bis(phenylmethyl) ester IUPAC Name: dibenzyl 2-(2-nitroethyl)pentanedioate Traditional Name: 2-(2-nitroethyl)glutaric acid dibenzyl ester Formula: C21H23NO6 MolecularWeight: 385.41042

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)CCC(CC[N+](=O)[O-])C(=O)OCC2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)CCC(CC[N+](=O)[O-])C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C21H23NO6/c23-20(27-15-17-7-3-1-4-8-17)12-11-19(13-14-22(25)26)21(24)28-16-18-9-5-2-6-10-18/h1-10,19H,11-16H2