5-[4-(2-ethyl-4-oxidanylidene-quinazolin-3-yl)butyl]-2-methyl-1,3-dioxane-2-carboxylic acid

Systemtic Name: 5-[4-(2-ethyl-4-oxidanylidene-quinazolin-3-yl)butyl]-2-methyl-1,3-dioxane-2-carboxylic acid Openeye Name: 5-[4-(2-ethyl-4-oxo-quinazolin-3-yl)butyl]-2-methyl-1,3-dioxane-2-carboxylic acid CAS Name: 5-[4-(2-ethyl-4-oxo-3-quinazolinyl)butyl]-2-methyl-1,3-dioxane-2-carboxylic acid IUPAC Name: 5-[4-(2-ethyl-4-oxoquinazolin-3-yl)butyl]-2-methyl-1,3-dioxane-2-carboxylic acid Traditional Name: 5-[4-(2-ethyl-4-keto-quinazolin-3-yl)butyl]-2-methyl-1,3-dioxane-2-carboxylic acid Formula: C20H26N2O5 MolecularWeight: 374.43084

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=CC=CC=C2C(=O)N1CCCCC3COC(OC3)(C)C(=O)O

Isomeric SMILES

CCC1=NC2=CC=CC=C2C(=O)N1CCCCC3COC(OC3)(C)C(=O)O

InChI

InChI=1S/C20H26N2O5/c1-3-17-21-16-10-5-4-9-15(16)18(23)22(17)11-7-6-8-14-12-26-20(2,19(24)25)27-13-14/h4-5,9-10,14H,3,6-8,11-13H2,1-2H3,(H,24,25)