dodecyl 3,5-dinitrobenzoate

Systemtic Name: dodecyl 3,5-dinitrobenzoate Openeye Name: dodecyl 3,5-dinitrobenzoate CAS Name: 3,5-dinitrobenzoic acid dodecyl ester IUPAC Name: dodecyl 3,5-dinitrobenzoate Traditional Name: 3,5-dinitrobenzoic acid lauryl ester Formula: C19H28N2O6 MolecularWeight: 380.43542

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCOC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C19H28N2O6/c1-2-3-4-5-6-7-8-9-10-11-12-27-19(22)16-13-17(20(23)24)15-18(14-16)21(25)26/h13-15H,2-12H2,1H3