[4-(4-nitrophenyl)carbonyloxy-1,3-dithiolan-2-yl]methyl 4-nitrobenzoate

Systemtic Name: [4-(4-nitrophenyl)carbonyloxy-1,3-dithiolan-2-yl]methyl 4-nitrobenzoate Openeye Name: [4-(4-nitrobenzoyl)oxy-1,3-dithiolan-2-yl]methyl 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [4-[(4-nitrophenyl)-oxomethoxy]-1,3-dithiolan-2-yl]methyl ester IUPAC Name: [4-(4-nitrobenzoyl)oxy-1,3-dithiolan-2-yl]methyl 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [4-(4-nitrobenzoyl)oxy-1,3-dithiolan-2-yl]methyl ester Formula: C18H14N2O8S2 MolecularWeight: 450.44236

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Descriptors Computed from Structure

Canonical SMILES:

C1C(SC(S1)COC(=O)C2=CC=C(C=C2)[N+](=O)[O-])OC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1C(SC(S1)COC(=O)C2=CC=C(C=C2)[N+](=O)[O-])OC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H14N2O8S2/c21-17(11-1-5-13(6-2-11)19(23)24)27-9-16-29-10-15(30-16)28-18(22)12-3-7-14(8-4-12)20(25)26/h1-8,15-16H,9-10H2