4-[4-oxidanylidene-2-[(E)-2-(2-prop-2-enoxyphenyl)ethenyl]quinazolin-3-yl]benzoic acid

Systemtic Name: 4-[4-oxidanylidene-2-[(E)-2-(2-prop-2-enoxyphenyl)ethenyl]quinazolin-3-yl]benzoic acid Openeye Name: 4-[2-[(E)-2-(2-allyloxyphenyl)vinyl]-4-oxo-quinazolin-3-yl]benzoic acid CAS Name: 4-[4-oxo-2-[(E)-2-(2-prop-2-enoxyphenyl)ethenyl]-3-quinazolinyl]benzoic acid IUPAC Name: 4-[4-oxo-2-[(E)-2-(2-prop-2-enoxyphenyl)ethenyl]quinazolin-3-yl]benzoic acid Traditional Name: 4-[2-[(E)-2-(2-allyloxyphenyl)vinyl]-4-keto-quinazolin-3-yl]benzoic acid Formula: C26H20N2O4 MolecularWeight: 424.448

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOC1=CC=CC=C1C=CC2=NC3=CC=CC=C3C(=O)N2C4=CC=C(C=C4)C(=O)O

Isomeric SMILES

C=CCOC1=CC=CC=C1/C=C/C2=NC3=CC=CC=C3C(=O)N2C4=CC=C(C=C4)C(=O)O

InChI

InChI=1S/C26H20N2O4/c1-2-17-32-23-10-6-3-7-18(23)13-16-24-27-22-9-5-4-8-21(22)25(29)28(24)20-14-11-19(12-15-20)26(30)31/h2-16H,1,17H2,(H,30,31)/b16-13+