[2-nitro-4-(2-nitrophenyl)carbonyl-6-phenylmethoxy-phenyl] 2,2-dimethylpropanoate

Systemtic Name: [2-nitro-4-(2-nitrophenyl)carbonyl-6-phenylmethoxy-phenyl] 2,2-dimethylpropanoate Openeye Name: [2-benzyloxy-6-nitro-4-(2-nitrobenzoyl)phenyl] 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid [2-nitro-4-[(2-nitrophenyl)-oxomethyl]-6-phenylmethoxyphenyl] ester IUPAC Name: [2-nitro-4-(2-nitrobenzoyl)-6-phenylmethoxyphenyl] 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid [2-benzoxy-6-nitro-4-(2-nitrobenzoyl)phenyl] ester Formula: C25H22N2O8 MolecularWeight: 478.45078

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)OC1=C(C=C(C=C1OCC2=CC=CC=C2)C(=O)C3=CC=CC=C3[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C(=O)OC1=C(C=C(C=C1OCC2=CC=CC=C2)C(=O)C3=CC=CC=C3[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C25H22N2O8/c1-25(2,3)24(29)35-23-20(27(32)33)13-17(14-21(23)34-15-16-9-5-4-6-10-16)22(28)18-11-7-8-12-19(18)26(30)31/h4-14H,15H2,1-3H3