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

Systemtic Name: 3-[2-[(E)-2-(3-ethoxy-4-propoxy-phenyl)ethenyl]-4-oxidanylidene-quinazolin-3-yl]propanoic acid Openeye Name: 3-[2-[(E)-2-(3-ethoxy-4-propoxy-phenyl)vinyl]-4-oxo-quinazolin-3-yl]propanoic acid CAS Name: 3-[2-[(E)-2-(3-ethoxy-4-propoxyphenyl)ethenyl]-4-oxo-3-quinazolinyl]propanoic acid IUPAC Name: 3-[2-[(E)-2-(3-ethoxy-4-propoxyphenyl)ethenyl]-4-oxoquinazolin-3-yl]propanoic acid Traditional Name: 3-[2-[(E)-2-(3-ethoxy-4-propoxy-phenyl)vinyl]-4-keto-quinazolin-3-yl]propionic acid Formula: C24H26N2O5 MolecularWeight: 422.47364

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C=CC2=NC3=CC=CC=C3C(=O)N2CCC(=O)O)OCC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)/C=C/C2=NC3=CC=CC=C3C(=O)N2CCC(=O)O)OCC

InChI

InChI=1S/C24H26N2O5/c1-3-15-31-20-11-9-17(16-21(20)30-4-2)10-12-22-25-19-8-6-5-7-18(19)24(29)26(22)14-13-23(27)28/h5-12,16H,3-4,13-15H2,1-2H3,(H,27,28)/b12-10+