ethyl 4-[7-chloranyl-1-ethyl-6-nitro-2,4-bis(oxidanylidene)quinazolin-3-yl]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[7-chloranyl-1-ethyl-6-nitro-2,4-bis(oxidanylidene)quinazolin-3-yl]piperidine-1-carboxylate Openeye Name: ethyl 4-(7-chloro-1-ethyl-6-nitro-2,4-dioxo-quinazolin-3-yl)piperidine-1-carboxylate CAS Name: 4-(7-chloro-1-ethyl-6-nitro-2,4-dioxo-3-quinazolinyl)-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(7-chloro-1-ethyl-6-nitro-2,4-dioxoquinazolin-3-yl)piperidine-1-carboxylate Traditional Name: 4-(7-chloro-1-ethyl-2,4-diketo-6-nitro-quinazolin-3-yl)piperidine-1-carboxylic acid ethyl ester Formula: C18H21ClN4O6 MolecularWeight: 424.83554

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC(=C(C=C2C(=O)N(C1=O)C3CCN(CC3)C(=O)OCC)[N+](=O)[O-])Cl

Isomeric SMILES

CCN1C2=CC(=C(C=C2C(=O)N(C1=O)C3CCN(CC3)C(=O)OCC)[N+](=O)[O-])Cl

InChI

InChI=1S/C18H21ClN4O6/c1-3-21-14-10-13(19)15(23(27)28)9-12(14)16(24)22(17(21)25)11-5-7-20(8-6-11)18(26)29-4-2/h9-11H,3-8H2,1-2H3