methyl 1-[1-(4-bromanylbutyl)-2,4-bis(oxidanylidene)quinazolin-3-yl]cyclohexane-1-carboxylate

Systemtic Name: methyl 1-[1-(4-bromanylbutyl)-2,4-bis(oxidanylidene)quinazolin-3-yl]cyclohexane-1-carboxylate Openeye Name: methyl 1-[1-(4-bromobutyl)-2,4-dioxo-quinazolin-3-yl]cyclohexanecarboxylate CAS Name: 1-[1-(4-bromobutyl)-2,4-dioxo-3-quinazolinyl]-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl 1-[1-(4-bromobutyl)-2,4-dioxoquinazolin-3-yl]cyclohexane-1-carboxylate Traditional Name: 1-[1-(4-bromobutyl)-2,4-diketo-quinazolin-3-yl]cyclohexanecarboxylic acid methyl ester Formula: C20H25BrN2O4 MolecularWeight: 437.3275

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1(CCCCC1)N2C(=O)C3=CC=CC=C3N(C2=O)CCCCBr

Isomeric SMILES

COC(=O)C1(CCCCC1)N2C(=O)C3=CC=CC=C3N(C2=O)CCCCBr

InChI

InChI=1S/C20H25BrN2O4/c1-27-18(25)20(11-5-2-6-12-20)23-17(24)15-9-3-4-10-16(15)22(19(23)26)14-8-7-13-21/h3-4,9-10H,2,5-8,11-14H2,1H3