4-methyl-2-[4-oxidanylidene-2-(3,4,5-trimethoxyphenyl)quinazolin-3-yl]pentanoic acid

Systemtic Name: 4-methyl-2-[4-oxidanylidene-2-(3,4,5-trimethoxyphenyl)quinazolin-3-yl]pentanoic acid Openeye Name: 4-methyl-2-[4-oxo-2-(3,4,5-trimethoxyphenyl)quinazolin-3-yl]pentanoic acid CAS Name: 4-methyl-2-[4-oxo-2-(3,4,5-trimethoxyphenyl)-3-quinazolinyl]pentanoic acid IUPAC Name: 4-methyl-2-[4-oxo-2-(3,4,5-trimethoxyphenyl)quinazolin-3-yl]pentanoic acid Traditional Name: 2-[4-keto-2-(3,4,5-trimethoxyphenyl)quinazolin-3-yl]-4-methyl-valeric acid Formula: C23H26N2O6 MolecularWeight: 426.46234

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)N1C(=NC2=CC=CC=C2C1=O)C3=CC(=C(C(=C3)OC)OC)OC

Isomeric SMILES

CC(C)CC(C(=O)O)N1C(=NC2=CC=CC=C2C1=O)C3=CC(=C(C(=C3)OC)OC)OC

InChI

InChI=1S/C23H26N2O6/c1-13(2)10-17(23(27)28)25-21(24-16-9-7-6-8-15(16)22(25)26)14-11-18(29-3)20(31-5)19(12-14)30-4/h6-9,11-13,17H,10H2,1-5H3,(H,27,28)