methyl (2S)-3-(4-hydroxyphenyl)-2-[[4-(4-oxidanylidenequinazolin-3-yl)phenyl]carbonylamino]propanoate

Systemtic Name: methyl (2S)-3-(4-hydroxyphenyl)-2-[[4-(4-oxidanylidenequinazolin-3-yl)phenyl]carbonylamino]propanoate Openeye Name: methyl (2S)-3-(4-hydroxyphenyl)-2-[[4-(4-oxoquinazolin-3-yl)benzoyl]amino]propanoate CAS Name: (2S)-3-(4-hydroxyphenyl)-2-[[oxo-[4-(4-oxo-3-quinazolinyl)phenyl]methyl]amino]propanoic acid methyl ester IUPAC Name: methyl (2S)-3-(4-hydroxyphenyl)-2-[[4-(4-oxoquinazolin-3-yl)benzoyl]amino]propanoate Traditional Name: (2S)-3-(4-hydroxyphenyl)-2-[[4-(4-ketoquinazolin-3-yl)benzoyl]amino]propionic acid methyl ester Formula: C25H21N3O5 MolecularWeight: 443.45134

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=C(C=C1)O)NC(=O)C2=CC=C(C=C2)N3C=NC4=CC=CC=C4C3=O

Isomeric SMILES

COC(=O)[C@H](CC1=CC=C(C=C1)O)NC(=O)C2=CC=C(C=C2)N3C=NC4=CC=CC=C4C3=O

InChI

InChI=1S/C25H21N3O5/c1-33-25(32)22(14-16-6-12-19(29)13-7-16)27-23(30)17-8-10-18(11-9-17)28-15-26-21-5-3-2-4-20(21)24(28)31/h2-13,15,22,29H,14H2,1H3,(H,27,30)/t22-/m0/s1