2-[2-[1-(4-bromanylbutyl)-2,4-bis(oxidanylidene)quinazolin-3-yl]ethyl]benzoate

Systemtic Name: 2-[2-[1-(4-bromanylbutyl)-2,4-bis(oxidanylidene)quinazolin-3-yl]ethyl]benzoate Openeye Name: 2-[2-[1-(4-bromobutyl)-2,4-dioxo-quinazolin-3-yl]ethyl]benzoate CAS Name: 2-[2-[1-(4-bromobutyl)-2,4-dioxo-3-quinazolinyl]ethyl]benzoate IUPAC Name: 2-[2-[1-(4-bromobutyl)-2,4-dioxoquinazolin-3-yl]ethyl]benzoate Traditional Name: 2-[2-[1-(4-bromobutyl)-2,4-diketo-quinazolin-3-yl]ethyl]benzoate Formula: C21H20BrN2O4- MolecularWeight: 444.2985

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CCN2C(=O)C3=CC=CC=C3N(C2=O)CCCCBr)C(=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)CCN2C(=O)C3=CC=CC=C3N(C2=O)CCCCBr)C(=O)[O-]

InChI

InChI=1S/C21H21BrN2O4/c22-12-5-6-13-23-18-10-4-3-9-17(18)19(25)24(21(23)28)14-11-15-7-1-2-8-16(15)20(26)27/h1-4,7-10H,5-6,11-14H2,(H,26,27)/p-1