3-[4-methyl-6,7-bis(2-methylpropoxy)-2-oxidanylidene-quinazolin-1-yl]propanoic acid

Systemtic Name: 3-[4-methyl-6,7-bis(2-methylpropoxy)-2-oxidanylidene-quinazolin-1-yl]propanoic acid Openeye Name: 3-(6,7-diisobutoxy-4-methyl-2-oxo-quinazolin-1-yl)propanoic acid CAS Name: 3-[4-methyl-6,7-bis(2-methylpropoxy)-2-oxo-1-quinazolinyl]propanoic acid IUPAC Name: 3-[4-methyl-6,7-bis(2-methylpropoxy)-2-oxoquinazolin-1-yl]propanoic acid Traditional Name: 3-(6,7-diisobutoxy-2-keto-4-methyl-quinazolin-1-yl)propionic acid Formula: C20H28N2O5 MolecularWeight: 376.44672

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=O)N(C2=CC(=C(C=C12)OCC(C)C)OCC(C)C)CCC(=O)O

Isomeric SMILES

CC1=NC(=O)N(C2=CC(=C(C=C12)OCC(C)C)OCC(C)C)CCC(=O)O

InChI

InChI=1S/C20H28N2O5/c1-12(2)10-26-17-8-15-14(5)21-20(25)22(7-6-19(23)24)16(15)9-18(17)27-11-13(3)4/h8-9,12-13H,6-7,10-11H2,1-5H3,(H,23,24)