3-methyl-2-[2-(4-oxidanylidenequinazolin-3-yl)propanoylamino]pentanoic acid

Systemtic Name: 3-methyl-2-[2-(4-oxidanylidenequinazolin-3-yl)propanoylamino]pentanoic acid Openeye Name: 3-methyl-2-[2-(4-oxoquinazolin-3-yl)propanoylamino]pentanoic acid CAS Name: 3-methyl-2-[[1-oxo-2-(4-oxo-3-quinazolinyl)propyl]amino]pentanoic acid IUPAC Name: 3-methyl-2-[2-(4-oxoquinazolin-3-yl)propanoylamino]pentanoic acid Traditional Name: 2-[2-(4-ketoquinazolin-3-yl)propanoylamino]-3-methyl-valeric acid Formula: C17H21N3O4 MolecularWeight: 331.36634

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)O)NC(=O)C(C)N1C=NC2=CC=CC=C2C1=O

Isomeric SMILES

CCC(C)C(C(=O)O)NC(=O)C(C)N1C=NC2=CC=CC=C2C1=O

InChI

InChI=1S/C17H21N3O4/c1-4-10(2)14(17(23)24)19-15(21)11(3)20-9-18-13-8-6-5-7-12(13)16(20)22/h5-11,14H,4H2,1-3H3,(H,19,21)(H,23,24)