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

Systemtic Name: 4-[4-oxidanylidene-2-[(E)-2-(4-prop-2-enoxyphenyl)ethenyl]quinazolin-3-yl]benzoic acid Openeye Name: 4-[2-[(E)-2-(4-allyloxyphenyl)vinyl]-4-oxo-quinazolin-3-yl]benzoic acid CAS Name: 4-[4-oxo-2-[(E)-2-(4-prop-2-enoxyphenyl)ethenyl]-3-quinazolinyl]benzoic acid IUPAC Name: 4-[4-oxo-2-[(E)-2-(4-prop-2-enoxyphenyl)ethenyl]quinazolin-3-yl]benzoic acid Traditional Name: 4-[2-[(E)-2-(4-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=C(C=C1)C=CC2=NC3=CC=CC=C3C(=O)N2C4=CC=C(C=C4)C(=O)O

Isomeric SMILES

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

InChI

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