ethyl 2-[6-(imidazol-1-ylmethyl)-3-oxidanylidene-4H-quinoxalin-2-yl]propanoate

Systemtic Name: ethyl 2-[6-(imidazol-1-ylmethyl)-3-oxidanylidene-4H-quinoxalin-2-yl]propanoate Openeye Name: ethyl 2-[6-(imidazol-1-ylmethyl)-3-oxo-4H-quinoxalin-2-yl]propanoate CAS Name: 2-[6-(1-imidazolylmethyl)-3-oxo-4H-quinoxalin-2-yl]propanoic acid ethyl ester IUPAC Name: ethyl 2-[6-(imidazol-1-ylmethyl)-3-oxo-4H-quinoxalin-2-yl]propanoate Traditional Name: 2-[6-(imidazol-1-ylmethyl)-3-keto-4H-quinoxalin-2-yl]propionic acid ethyl ester Formula: C17H18N4O3 MolecularWeight: 326.34982

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)C1=NC2=C(C=C(C=C2)CN3C=CN=C3)NC1=O

Isomeric SMILES

CCOC(=O)C(C)C1=NC2=C(C=C(C=C2)CN3C=CN=C3)NC1=O

InChI

InChI=1S/C17H18N4O3/c1-3-24-17(23)11(2)15-16(22)20-14-8-12(4-5-13(14)19-15)9-21-7-6-18-10-21/h4-8,10-11H,3,9H2,1-2H3,(H,20,22)