3-methyl-2-[2-(4-oxidanylidenequinazolin-3-yl)hexanoylamino]butanoic acid

Systemtic Name: 3-methyl-2-[2-(4-oxidanylidenequinazolin-3-yl)hexanoylamino]butanoic acid Openeye Name: 3-methyl-2-[2-(4-oxoquinazolin-3-yl)hexanoylamino]butanoic acid CAS Name: 3-methyl-2-[[1-oxo-2-(4-oxo-3-quinazolinyl)hexyl]amino]butanoic acid IUPAC Name: 3-methyl-2-[2-(4-oxoquinazolin-3-yl)hexanoylamino]butanoic acid Traditional Name: 2-[2-(4-ketoquinazolin-3-yl)hexanoylamino]-3-methyl-butyric acid Formula: C19H25N3O4 MolecularWeight: 359.4195

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H25N3O4/c1-4-5-10-15(17(23)21-16(12(2)3)19(25)26)22-11-20-14-9-7-6-8-13(14)18(22)24/h6-9,11-12,15-16H,4-5,10H2,1-3H3,(H,21,23)(H,25,26)