[5-(3,5-dinitrophenyl)carbonyloxy-4-methyl-pentyl] 3,5-dinitrobenzoate

Systemtic Name: [5-(3,5-dinitrophenyl)carbonyloxy-4-methyl-pentyl] 3,5-dinitrobenzoate Openeye Name: [5-(3,5-dinitrobenzoyl)oxy-4-methyl-pentyl] 3,5-dinitrobenzoate CAS Name: 3,5-dinitrobenzoic acid [5-[(3,5-dinitrophenyl)-oxomethoxy]-4-methylpentyl] ester IUPAC Name: [5-(3,5-dinitrobenzoyl)oxy-4-methylpentyl] 3,5-dinitrobenzoate Traditional Name: 3,5-dinitrobenzoic acid [5-(3,5-dinitrobenzoyl)oxy-4-methyl-pentyl] ester Formula: C20H18N4O12 MolecularWeight: 506.37652

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCOC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])[N+](=O)[O-])COC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC(CCCOC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])[N+](=O)[O-])COC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C20H18N4O12/c1-12(11-36-20(26)14-7-17(23(31)32)10-18(8-14)24(33)34)3-2-4-35-19(25)13-5-15(21(27)28)9-16(6-13)22(29)30/h5-10,12H,2-4,11H2,1H3