ethyl 3-ethyl-4-[1-ethyl-6,8-dinitro-2,4-bis(oxidanylidene)quinazolin-3-yl]piperidine-1-carboxylate

Systemtic Name: ethyl 3-ethyl-4-[1-ethyl-6,8-dinitro-2,4-bis(oxidanylidene)quinazolin-3-yl]piperidine-1-carboxylate Openeye Name: ethyl 3-ethyl-4-(1-ethyl-6,8-dinitro-2,4-dioxo-quinazolin-3-yl)piperidine-1-carboxylate CAS Name: 3-ethyl-4-(1-ethyl-6,8-dinitro-2,4-dioxo-3-quinazolinyl)-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-ethyl-4-(1-ethyl-6,8-dinitro-2,4-dioxoquinazolin-3-yl)piperidine-1-carboxylate Traditional Name: 3-ethyl-4-(1-ethyl-2,4-diketo-6,8-dinitro-quinazolin-3-yl)piperidine-1-carboxylic acid ethyl ester Formula: C20H25N5O8 MolecularWeight: 463.4412

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CN(CCC1N2C(=O)C3=CC(=CC(=C3N(C2=O)CC)[N+](=O)[O-])[N+](=O)[O-])C(=O)OCC

Isomeric SMILES

CCC1CN(CCC1N2C(=O)C3=CC(=CC(=C3N(C2=O)CC)[N+](=O)[O-])[N+](=O)[O-])C(=O)OCC

InChI

InChI=1S/C20H25N5O8/c1-4-12-11-21(20(28)33-6-3)8-7-15(12)23-18(26)14-9-13(24(29)30)10-16(25(31)32)17(14)22(5-2)19(23)27/h9-10,12,15H,4-8,11H2,1-3H3