3-(4-fluoranylphenoxy)propyl 2-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]ethanoate

Systemtic Name: 3-(4-fluoranylphenoxy)propyl 2-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]ethanoate Openeye Name: 3-(4-fluorophenoxy)propyl 2-(4-nitro-1,3-dioxo-isoindolin-2-yl)acetate CAS Name: 2-(4-nitro-1,3-dioxo-2-isoindolyl)acetic acid 3-(4-fluorophenoxy)propyl ester IUPAC Name: 3-(4-fluorophenoxy)propyl 2-(4-nitro-1,3-dioxoisoindol-2-yl)acetate Traditional Name: 2-(1,3-diketo-4-nitro-isoindolin-2-yl)acetic acid 3-(4-fluorophenoxy)propyl ester Formula: C19H15FN2O7 MolecularWeight: 402.330003

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)[N+](=O)[O-])C(=O)N(C2=O)CC(=O)OCCCOC3=CC=C(C=C3)F

Isomeric SMILES

C1=CC2=C(C(=C1)[N+](=O)[O-])C(=O)N(C2=O)CC(=O)OCCCOC3=CC=C(C=C3)F

InChI

InChI=1S/C19H15FN2O7/c20-12-5-7-13(8-6-12)28-9-2-10-29-16(23)11-21-18(24)14-3-1-4-15(22(26)27)17(14)19(21)25/h1,3-8H,2,9-11H2