bis(4-nitrophenyl) hexanedioate

Systemtic Name: bis(4-nitrophenyl) hexanedioate Openeye Name: bis(4-nitrophenyl) hexanedioate CAS Name: hexanedioic acid bis(4-nitrophenyl) ester IUPAC Name: bis(4-nitrophenyl) hexanedioate Traditional Name: adipic acid bis(4-nitrophenyl) ester Formula: C18H16N2O8 MolecularWeight: 388.32824

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1[N+](=O)[O-])OC(=O)CCCCC(=O)OC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1[N+](=O)[O-])OC(=O)CCCCC(=O)OC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H16N2O8/c21-17(27-15-9-5-13(6-10-15)19(23)24)3-1-2-4-18(22)28-16-11-7-14(8-12-16)20(25)26/h5-12H,1-4H2