2,3-bis[(4-nitrophenyl)carbonyloxy]propyl 4-nitrobenzoate

Systemtic Name: 2,3-bis[(4-nitrophenyl)carbonyloxy]propyl 4-nitrobenzoate Openeye Name: 2,3-bis[(4-nitrobenzoyl)oxy]propyl 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid 2,3-bis[(4-nitrophenyl)-oxomethoxy]propyl ester IUPAC Name: 2,3-bis[(4-nitrobenzoyl)oxy]propyl 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid 2,3-bis[(4-nitrobenzoyl)oxy]propyl ester Formula: C24H17N3O12 MolecularWeight: 539.40468

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)OCC(COC(=O)C2=CC=C(C=C2)[N+](=O)[O-])OC(=O)C3=CC=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(=O)OCC(COC(=O)C2=CC=C(C=C2)[N+](=O)[O-])OC(=O)C3=CC=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C24H17N3O12/c28-22(15-1-7-18(8-2-15)25(31)32)37-13-21(39-24(30)17-5-11-20(12-6-17)27(35)36)14-38-23(29)16-3-9-19(10-4-16)26(33)34/h1-12,21H,13-14H2