3-[4-[(E)-2-(4-oxidanylidene-3-phenyl-quinazolin-2-yl)ethenyl]phenoxy]propanoic acid

Systemtic Name: 3-[4-[(E)-2-(4-oxidanylidene-3-phenyl-quinazolin-2-yl)ethenyl]phenoxy]propanoic acid Openeye Name: 3-[4-[(E)-2-(4-oxo-3-phenyl-quinazolin-2-yl)vinyl]phenoxy]propanoic acid CAS Name: 3-[4-[(E)-2-(4-oxo-3-phenyl-2-quinazolinyl)ethenyl]phenoxy]propanoic acid IUPAC Name: 3-[4-[(E)-2-(4-oxo-3-phenylquinazolin-2-yl)ethenyl]phenoxy]propanoic acid Traditional Name: 3-[4-[(E)-2-(4-keto-3-phenyl-quinazolin-2-yl)vinyl]phenoxy]propionic acid Formula: C25H20N2O4 MolecularWeight: 412.4373

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NC3=CC=CC=C3C2=O)C=CC4=CC=C(C=C4)OCCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NC3=CC=CC=C3C2=O)/C=C/C4=CC=C(C=C4)OCCC(=O)O

InChI

InChI=1S/C25H20N2O4/c28-24(29)16-17-31-20-13-10-18(11-14-20)12-15-23-26-22-9-5-4-8-21(22)25(30)27(23)19-6-2-1-3-7-19/h1-15H,16-17H2,(H,28,29)/b15-12+