1-(4-bromanylbutyl)-2,4-bis(oxidanylidene)quinazoline-5-carboxylic acid

Systemtic Name: 1-(4-bromanylbutyl)-2,4-bis(oxidanylidene)quinazoline-5-carboxylic acid Openeye Name: 1-(4-bromobutyl)-2,4-dioxo-quinazoline-5-carboxylic acid CAS Name: 1-(4-bromobutyl)-2,4-dioxo-5-quinazolinecarboxylic acid IUPAC Name: 1-(4-bromobutyl)-2,4-dioxoquinazoline-5-carboxylic acid Traditional Name: 1-(4-bromobutyl)-2,4-diketo-quinazoline-5-carboxylic acid Formula: C13H13BrN2O4 MolecularWeight: 341.15732

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C2C(=C1)N(C(=O)NC2=O)CCCCBr)C(=O)O

Isomeric SMILES

C1=CC(=C2C(=C1)N(C(=O)NC2=O)CCCCBr)C(=O)O

InChI

InChI=1S/C13H13BrN2O4/c14-6-1-2-7-16-9-5-3-4-8(12(18)19)10(9)11(17)15-13(16)20/h3-5H,1-2,6-7H2,(H,18,19)(H,15,17,20)