propan-2-yl 5-[7-fluoranyl-6-nitro-2,3-bis(oxidanylidene)-4H-quinoxalin-1-yl]pentanoate

Systemtic Name: propan-2-yl 5-[7-fluoranyl-6-nitro-2,3-bis(oxidanylidene)-4H-quinoxalin-1-yl]pentanoate Openeye Name: isopropyl 5-(7-fluoro-6-nitro-2,3-dioxo-4H-quinoxalin-1-yl)pentanoate CAS Name: 5-(7-fluoro-6-nitro-2,3-dioxo-4H-quinoxalin-1-yl)pentanoic acid propan-2-yl ester IUPAC Name: propan-2-yl 5-(7-fluoro-6-nitro-2,3-dioxo-4H-quinoxalin-1-yl)pentanoate Traditional Name: 5-(7-fluoro-2,3-diketo-6-nitro-4H-quinoxalin-1-yl)valeric acid isopropyl ester Formula: C16H18FN3O6 MolecularWeight: 367.329023

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)CCCCN1C2=CC(=C(C=C2NC(=O)C1=O)[N+](=O)[O-])F

Isomeric SMILES

CC(C)OC(=O)CCCCN1C2=CC(=C(C=C2NC(=O)C1=O)[N+](=O)[O-])F

InChI

InChI=1S/C16H18FN3O6/c1-9(2)26-14(21)5-3-4-6-19-13-7-10(17)12(20(24)25)8-11(13)18-15(22)16(19)23/h7-9H,3-6H2,1-2H3,(H,18,22)