3-(4-hydroxyphenyl)-2-[[2-(4-oxidanylidenequinazolin-3-yl)-2-phenyl-ethanoyl]amino]propanoic acid

Systemtic Name: 3-(4-hydroxyphenyl)-2-[[2-(4-oxidanylidenequinazolin-3-yl)-2-phenyl-ethanoyl]amino]propanoic acid Openeye Name: 3-(4-hydroxyphenyl)-2-[[2-(4-oxoquinazolin-3-yl)-2-phenyl-acetyl]amino]propanoic acid CAS Name: 3-(4-hydroxyphenyl)-2-[[1-oxo-2-(4-oxo-3-quinazolinyl)-2-phenylethyl]amino]propanoic acid IUPAC Name: 3-(4-hydroxyphenyl)-2-[[2-(4-oxoquinazolin-3-yl)-2-phenylacetyl]amino]propanoic acid Traditional Name: 3-(4-hydroxyphenyl)-2-[[2-(4-ketoquinazolin-3-yl)-2-phenyl-acetyl]amino]propionic acid Formula: C25H21N3O5 MolecularWeight: 443.45134

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(=O)NC(CC2=CC=C(C=C2)O)C(=O)O)N3C=NC4=CC=CC=C4C3=O

Isomeric SMILES

C1=CC=C(C=C1)C(C(=O)NC(CC2=CC=C(C=C2)O)C(=O)O)N3C=NC4=CC=CC=C4C3=O

InChI

InChI=1S/C25H21N3O5/c29-18-12-10-16(11-13-18)14-21(25(32)33)27-23(30)22(17-6-2-1-3-7-17)28-15-26-20-9-5-4-8-19(20)24(28)31/h1-13,15,21-22,29H,14H2,(H,27,30)(H,32,33)