2,4-dihydro-1H-quinazolin-3-yl 1-(4-bromanylbutyl)-4,6-bis(oxidanylidene)cyclohex-2-ene-1-carboxylate

Systemtic Name: 2,4-dihydro-1H-quinazolin-3-yl 1-(4-bromanylbutyl)-4,6-bis(oxidanylidene)cyclohex-2-ene-1-carboxylate Openeye Name: 2,4-dihydro-1H-quinazolin-3-yl 1-(4-bromobutyl)-4,6-dioxo-cyclohex-2-ene-1-carboxylate CAS Name: 1-(4-bromobutyl)-4,6-dioxo-1-cyclohex-2-enecarboxylic acid 2,4-dihydro-1H-quinazolin-3-yl ester IUPAC Name: 2,4-dihydro-1H-quinazolin-3-yl 1-(4-bromobutyl)-4,6-dioxocyclohex-2-ene-1-carboxylate Traditional Name: 1-(4-bromobutyl)-4,6-diketo-cyclohex-2-ene-1-carboxylic acid 2,4-dihydro-1H-quinazolin-3-yl ester Formula: C19H21BrN2O4 MolecularWeight: 421.28504

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)C=CC(C1=O)(CCCCBr)C(=O)ON2CC3=CC=CC=C3NC2

Isomeric SMILES

C1C(=O)C=CC(C1=O)(CCCCBr)C(=O)ON2CC3=CC=CC=C3NC2

InChI

InChI=1S/C19H21BrN2O4/c20-10-4-3-8-19(9-7-15(23)11-17(19)24)18(25)26-22-12-14-5-1-2-6-16(14)21-13-22/h1-2,5-7,9,21H,3-4,8,10-13H2