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

Systemtic Name: ethyl 4-[1-(2-methylpropyl)-6-nitro-2,4-bis(oxidanylidene)quinazolin-3-yl]piperidine-1-carboxylate Openeye Name: ethyl 4-(1-isobutyl-6-nitro-2,4-dioxo-quinazolin-3-yl)piperidine-1-carboxylate CAS Name: 4-[1-(2-methylpropyl)-6-nitro-2,4-dioxo-3-quinazolinyl]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[1-(2-methylpropyl)-6-nitro-2,4-dioxoquinazolin-3-yl]piperidine-1-carboxylate Traditional Name: 4-(1-isobutyl-2,4-diketo-6-nitro-quinazolin-3-yl)piperidine-1-carboxylic acid ethyl ester Formula: C20H26N4O6 MolecularWeight: 418.44364

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)N2C(=O)C3=C(C=CC(=C3)[N+](=O)[O-])N(C2=O)CC(C)C

Isomeric SMILES

CCOC(=O)N1CCC(CC1)N2C(=O)C3=C(C=CC(=C3)[N+](=O)[O-])N(C2=O)CC(C)C

InChI

InChI=1S/C20H26N4O6/c1-4-30-20(27)21-9-7-14(8-10-21)23-18(25)16-11-15(24(28)29)5-6-17(16)22(19(23)26)12-13(2)3/h5-6,11,13-14H,4,7-10,12H2,1-3H3