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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)NC(=O)CCN1C=NC2=CC=CC=C2C1=O

Isomeric SMILES

CC(C)CC(C(=O)O)NC(=O)CCN1C=NC2=CC=CC=C2C1=O

InChI

InChI=1S/C17H21N3O4/c1-11(2)9-14(17(23)24)19-15(21)7-8-20-10-18-13-6-4-3-5-12(13)16(20)22/h3-6,10-11,14H,7-9H2,1-2H3,(H,19,21)(H,23,24)