[5-methoxy-3,4-bis[(4-nitrophenyl)carbonyloxy]oxolan-2-yl]methyl 4-nitrobenzoate

Systemtic Name: [5-methoxy-3,4-bis[(4-nitrophenyl)carbonyloxy]oxolan-2-yl]methyl 4-nitrobenzoate Openeye Name: [5-methoxy-3,4-bis[(4-nitrobenzoyl)oxy]tetrahydrofuran-2-yl]methyl 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [5-methoxy-3,4-bis[(4-nitrophenyl)-oxomethoxy]-2-oxolanyl]methyl ester IUPAC Name: [5-methoxy-3,4-bis[(4-nitrobenzoyl)oxy]oxolan-2-yl]methyl 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [5-methoxy-3,4-bis[(4-nitrobenzoyl)oxy]tetrahydrofuran-2-yl]methyl ester Formula: C27H21N3O14 MolecularWeight: 611.46734

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Descriptors Computed from Structure

Canonical SMILES:

COC1C(C(C(O1)COC(=O)C2=CC=C(C=C2)[N+](=O)[O-])OC(=O)C3=CC=C(C=C3)[N+](=O)[O-])OC(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

COC1C(C(C(O1)COC(=O)C2=CC=C(C=C2)[N+](=O)[O-])OC(=O)C3=CC=C(C=C3)[N+](=O)[O-])OC(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C27H21N3O14/c1-40-27-23(44-26(33)17-6-12-20(13-7-17)30(38)39)22(43-25(32)16-4-10-19(11-5-16)29(36)37)21(42-27)14-41-24(31)15-2-8-18(9-3-15)28(34)35/h2-13,21-23,27H,14H2,1H3