3-methyl-2-[2-(quinoxalin-2-ylcarbonylamino)propanoylamino]butanoic acid

Systemtic Name: 3-methyl-2-[2-(quinoxalin-2-ylcarbonylamino)propanoylamino]butanoic acid Openeye Name: 3-methyl-2-[2-(quinoxaline-2-carbonylamino)propanoylamino]butanoic acid CAS Name: 3-methyl-2-[[1-oxo-2-[[oxo(2-quinoxalinyl)methyl]amino]propyl]amino]butanoic acid IUPAC Name: 3-methyl-2-[2-(quinoxaline-2-carbonylamino)propanoylamino]butanoic acid Traditional Name: 3-methyl-2-[2-(quinoxaline-2-carbonylamino)propanoylamino]butyric acid Formula: C17H20N4O4 MolecularWeight: 344.3651

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NC(=O)C(C)NC(=O)C1=NC2=CC=CC=C2N=C1

Isomeric SMILES

CC(C)C(C(=O)O)NC(=O)C(C)NC(=O)C1=NC2=CC=CC=C2N=C1

InChI

InChI=1S/C17H20N4O4/c1-9(2)14(17(24)25)21-15(22)10(3)19-16(23)13-8-18-11-6-4-5-7-12(11)20-13/h4-10,14H,1-3H3,(H,19,23)(H,21,22)(H,24,25)