ethyl 3,5-dinitro-4-piperidin-1-yl-benzoate

Systemtic Name: ethyl 3,5-dinitro-4-piperidin-1-yl-benzoate Openeye Name: ethyl 3,5-dinitro-4-(1-piperidyl)benzoate CAS Name: 3,5-dinitro-4-(1-piperidinyl)benzoic acid ethyl ester IUPAC Name: ethyl 3,5-dinitro-4-piperidin-1-ylbenzoate Traditional Name: 3,5-dinitro-4-piperidino-benzoic acid ethyl ester Formula: C14H17N3O6 MolecularWeight: 323.30128

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C(=C1)[N+](=O)[O-])N2CCCCC2)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC(=C(C(=C1)[N+](=O)[O-])N2CCCCC2)[N+](=O)[O-]

InChI

InChI=1S/C14H17N3O6/c1-2-23-14(18)10-8-11(16(19)20)13(12(9-10)17(21)22)15-6-4-3-5-7-15/h8-9H,2-7H2,1H3