4-oxidanylidene-3-[[1-[2-(quinoxalin-2-ylcarbonylamino)propanoyl]pyrrolidin-2-yl]carbonylamino]butanoic acid

Systemtic Name: 4-oxidanylidene-3-[[1-[2-(quinoxalin-2-ylcarbonylamino)propanoyl]pyrrolidin-2-yl]carbonylamino]butanoic acid Openeye Name: 4-oxo-3-[[1-[2-(quinoxaline-2-carbonylamino)propanoyl]pyrrolidine-2-carbonyl]amino]butanoic acid CAS Name: 4-oxo-3-[[oxo-[1-[1-oxo-2-[[oxo(2-quinoxalinyl)methyl]amino]propyl]-2-pyrrolidinyl]methyl]amino]butanoic acid IUPAC Name: 4-oxo-3-[[1-[2-(quinoxaline-2-carbonylamino)propanoyl]pyrrolidine-2-carbonyl]amino]butanoic acid Traditional Name: 4-keto-3-[[1-[2-(quinoxaline-2-carbonylamino)propanoyl]prolyl]amino]butyric acid Formula: C21H23N5O6 MolecularWeight: 441.43722

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCCC1C(=O)NC(CC(=O)O)C=O)NC(=O)C2=NC3=CC=CC=C3N=C2

Isomeric SMILES

CC(C(=O)N1CCCC1C(=O)NC(CC(=O)O)C=O)NC(=O)C2=NC3=CC=CC=C3N=C2

InChI

InChI=1S/C21H23N5O6/c1-12(23-19(30)16-10-22-14-5-2-3-6-15(14)25-16)21(32)26-8-4-7-17(26)20(31)24-13(11-27)9-18(28)29/h2-3,5-6,10-13,17H,4,7-9H2,1H3,(H,23,30)(H,24,31)(H,28,29)