ethyl 3-[2,3-bis(oxidanylidene)-7-pyrrol-1-yl-6-(trifluoromethyl)-4H-quinoxalin-1-yl]propanoate

Systemtic Name: ethyl 3-[2,3-bis(oxidanylidene)-7-pyrrol-1-yl-6-(trifluoromethyl)-4H-quinoxalin-1-yl]propanoate Openeye Name: ethyl 3-[2,3-dioxo-7-pyrrol-1-yl-6-(trifluoromethyl)-4H-quinoxalin-1-yl]propanoate CAS Name: 3-[2,3-dioxo-7-(1-pyrrolyl)-6-(trifluoromethyl)-4H-quinoxalin-1-yl]propanoic acid ethyl ester IUPAC Name: ethyl 3-[2,3-dioxo-7-pyrrol-1-yl-6-(trifluoromethyl)-4H-quinoxalin-1-yl]propanoate Traditional Name: 3-[2,3-diketo-7-pyrrol-1-yl-6-(trifluoromethyl)-4H-quinoxalin-1-yl]propionic acid ethyl ester Formula: C18H16F3N3O4 MolecularWeight: 395.33255

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCN1C2=C(C=C(C(=C2)N3C=CC=C3)C(F)(F)F)NC(=O)C1=O

Isomeric SMILES

CCOC(=O)CCN1C2=C(C=C(C(=C2)N3C=CC=C3)C(F)(F)F)NC(=O)C1=O

InChI

InChI=1S/C18H16F3N3O4/c1-2-28-15(25)5-8-24-14-10-13(23-6-3-4-7-23)11(18(19,20)21)9-12(14)22-16(26)17(24)27/h3-4,6-7,9-10H,2,5,8H2,1H3,(H,22,26)