[3-[(3,5-ditert-butyl-4-oxidanyl-phenyl)methoxy]-2-(3-nitrophenyl)carbonyloxy-propyl] 3-nitrobenzoate

Systemtic Name: [3-[(3,5-ditert-butyl-4-oxidanyl-phenyl)methoxy]-2-(3-nitrophenyl)carbonyloxy-propyl] 3-nitrobenzoate Openeye Name: [3-[(3,5-ditert-butyl-4-hydroxy-phenyl)methoxy]-2-(3-nitrobenzoyl)oxy-propyl] 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid [3-[(3,5-ditert-butyl-4-hydroxyphenyl)methoxy]-2-[(3-nitrophenyl)-oxomethoxy]propyl] ester IUPAC Name: [3-[(3,5-ditert-butyl-4-hydroxyphenyl)methoxy]-2-(3-nitrobenzoyl)oxypropyl] 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid [3-(3,5-ditert-butyl-4-hydroxy-benzyl)oxy-2-(3-nitrobenzoyl)oxy-propyl] ester Formula: C32H36N2O10 MolecularWeight: 608.63564

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)COCC(COC(=O)C2=CC(=CC=C2)[N+](=O)[O-])OC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)COCC(COC(=O)C2=CC(=CC=C2)[N+](=O)[O-])OC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C32H36N2O10/c1-31(2,3)26-13-20(14-27(28(26)35)32(4,5)6)17-42-18-25(44-30(37)22-10-8-12-24(16-22)34(40)41)19-43-29(36)21-9-7-11-23(15-21)33(38)39/h7-16,25,35H,17-19H2,1-6H3