(2S)-2-[[(2S)-2-(4-oxidanylidenequinazolin-3-yl)-3-phenyl-propanoyl]amino]propanoic acid

Systemtic Name: (2S)-2-[[(2S)-2-(4-oxidanylidenequinazolin-3-yl)-3-phenyl-propanoyl]amino]propanoic acid Openeye Name: (2S)-2-[[(2S)-2-(4-oxoquinazolin-3-yl)-3-phenyl-propanoyl]amino]propanoic acid CAS Name: (2S)-2-[[(2S)-1-oxo-2-(4-oxo-3-quinazolinyl)-3-phenylpropyl]amino]propanoic acid IUPAC Name: (2S)-2-[[(2S)-2-(4-oxoquinazolin-3-yl)-3-phenylpropanoyl]amino]propanoic acid Traditional Name: (2S)-2-[[(2S)-2-(4-ketoquinazolin-3-yl)-3-phenyl-propanoyl]amino]propionic acid Formula: C20H19N3O4 MolecularWeight: 365.38256

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)NC(=O)C(CC1=CC=CC=C1)N2C=NC3=CC=CC=C3C2=O

Isomeric SMILES

C[C@@H](C(=O)O)NC(=O)[C@H](CC1=CC=CC=C1)N2C=NC3=CC=CC=C3C2=O

InChI

InChI=1S/C20H19N3O4/c1-13(20(26)27)22-18(24)17(11-14-7-3-2-4-8-14)23-12-21-16-10-6-5-9-15(16)19(23)25/h2-10,12-13,17H,11H2,1H3,(H,22,24)(H,26,27)/t13-,17-/m0/s1