2-(5,5-dinitro-2-oxidanylidene-piperidin-1-yl)ethyl benzoate

Systemtic Name: 2-(5,5-dinitro-2-oxidanylidene-piperidin-1-yl)ethyl benzoate Openeye Name: 2-(5,5-dinitro-2-oxo-1-piperidyl)ethyl benzoate CAS Name: benzoic acid 2-(5,5-dinitro-2-oxo-1-piperidinyl)ethyl ester IUPAC Name: 2-(5,5-dinitro-2-oxopiperidin-1-yl)ethyl benzoate Traditional Name: benzoic acid 2-(2-keto-5,5-dinitro-piperidino)ethyl ester Formula: C14H15N3O7 MolecularWeight: 337.2848

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1=O)CCOC(=O)C2=CC=CC=C2)([N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1CC(CN(C1=O)CCOC(=O)C2=CC=CC=C2)([N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C14H15N3O7/c18-12-6-7-14(16(20)21,17(22)23)10-15(12)8-9-24-13(19)11-4-2-1-3-5-11/h1-5H,6-10H2