3-(7-cyano-8-morpholin-4-yl-4-oxidanylidene-5H-[1,2,4]triazolo[4,3-a]quinoxalin-1-yl)propanoic acid

Systemtic Name: 3-(7-cyano-8-morpholin-4-yl-4-oxidanylidene-5H-[1,2,4]triazolo[4,3-a]quinoxalin-1-yl)propanoic acid Openeye Name: 3-(7-cyano-8-morpholino-4-oxo-5H-[1,2,4]triazolo[4,3-a]quinoxalin-1-yl)propanoic acid CAS Name: 3-[7-cyano-8-(4-morpholinyl)-4-oxo-5H-[1,2,4]triazolo[4,3-a]quinoxalin-1-yl]propanoic acid IUPAC Name: 3-(7-cyano-8-morpholin-4-yl-4-oxo-5H-[1,2,4]triazolo[4,3-a]quinoxalin-1-yl)propanoic acid Traditional Name: 3-(7-cyano-4-keto-8-morpholino-5H-[1,2,4]triazolo[4,3-a]quinoxalin-1-yl)propionic acid Formula: C17H16N6O4 MolecularWeight: 368.34674

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=CC3=C(C=C2C#N)NC(=O)C4=NN=C(N34)CCC(=O)O

Isomeric SMILES

C1COCCN1C2=CC3=C(C=C2C#N)NC(=O)C4=NN=C(N34)CCC(=O)O

InChI

InChI=1S/C17H16N6O4/c18-9-10-7-11-13(8-12(10)22-3-5-27-6-4-22)23-14(1-2-15(24)25)20-21-16(23)17(26)19-11/h7-8H,1-6H2,(H,19,26)(H,24,25)