2-phenoxyethyl 3,5-dinitrobenzoate

Systemtic Name: 2-phenoxyethyl 3,5-dinitrobenzoate Openeye Name: 2-phenoxyethyl 3,5-dinitrobenzoate CAS Name: 3,5-dinitrobenzoic acid 2-phenoxyethyl ester IUPAC Name: 2-phenoxyethyl 3,5-dinitrobenzoate Traditional Name: 3,5-dinitrobenzoic acid 2-phenoxyethyl ester Formula: C15H12N2O7 MolecularWeight: 332.26498

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCCOC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)OCCOC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C15H12N2O7/c18-15(24-7-6-23-14-4-2-1-3-5-14)11-8-12(16(19)20)10-13(9-11)17(21)22/h1-5,8-10H,6-7H2