2-[1-(4-bromanylbutyl)-6-(2-methoxyethoxymethoxy)-2,4-bis(oxidanylidene)quinazolin-3-yl]pentanoate

Systemtic Name: 2-[1-(4-bromanylbutyl)-6-(2-methoxyethoxymethoxy)-2,4-bis(oxidanylidene)quinazolin-3-yl]pentanoate Openeye Name: 2-[1-(4-bromobutyl)-6-(2-methoxyethoxymethoxy)-2,4-dioxo-quinazolin-3-yl]pentanoate CAS Name: 2-[1-(4-bromobutyl)-6-(2-methoxyethoxymethoxy)-2,4-dioxo-3-quinazolinyl]pentanoate IUPAC Name: 2-[1-(4-bromobutyl)-6-(2-methoxyethoxymethoxy)-2,4-dioxoquinazolin-3-yl]pentanoate Traditional Name: 2-[1-(4-bromobutyl)-2,4-diketo-6-(2-methoxyethoxymethoxy)quinazolin-3-yl]valerate Formula: C21H28BrN2O7- MolecularWeight: 500.36022

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)[O-])N1C(=O)C2=C(C=CC(=C2)OCOCCOC)N(C1=O)CCCCBr

Isomeric SMILES

CCCC(C(=O)[O-])N1C(=O)C2=C(C=CC(=C2)OCOCCOC)N(C1=O)CCCCBr

InChI

InChI=1S/C21H29BrN2O7/c1-3-6-18(20(26)27)24-19(25)16-13-15(31-14-30-12-11-29-2)7-8-17(16)23(21(24)28)10-5-4-9-22/h7-8,13,18H,3-6,9-12,14H2,1-2H3,(H,26,27)/p-1