(2R)-2-[[(2S)-2-[1-methyl-2,4-bis(oxidanylidene)quinazolin-3-yl]-3-phenyl-propanoyl]amino]propanoic acid

Systemtic Name: (2R)-2-[[(2S)-2-[1-methyl-2,4-bis(oxidanylidene)quinazolin-3-yl]-3-phenyl-propanoyl]amino]propanoic acid Openeye Name: (2R)-2-[[(2S)-2-(1-methyl-2,4-dioxo-quinazolin-3-yl)-3-phenyl-propanoyl]amino]propanoic acid CAS Name: (2R)-2-[[(2S)-2-(1-methyl-2,4-dioxo-3-quinazolinyl)-1-oxo-3-phenylpropyl]amino]propanoic acid IUPAC Name: (2R)-2-[[(2S)-2-(1-methyl-2,4-dioxoquinazolin-3-yl)-3-phenylpropanoyl]amino]propanoic acid Traditional Name: (2R)-2-[[(2S)-2-(2,4-diketo-1-methyl-quinazolin-3-yl)-3-phenyl-propanoyl]amino]propionic acid Formula: C21H21N3O5 MolecularWeight: 395.40854

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)NC(=O)C(CC1=CC=CC=C1)N2C(=O)C3=CC=CC=C3N(C2=O)C

Isomeric SMILES

C[C@H](C(=O)O)NC(=O)[C@H](CC1=CC=CC=C1)N2C(=O)C3=CC=CC=C3N(C2=O)C

InChI

InChI=1S/C21H21N3O5/c1-13(20(27)28)22-18(25)17(12-14-8-4-3-5-9-14)24-19(26)15-10-6-7-11-16(15)23(2)21(24)29/h3-11,13,17H,12H2,1-2H3,(H,22,25)(H,27,28)/t13-,17+/m1/s1