4-[4-(4-bromanyl-2-fluoranyl-phenoxy)phenoxy]-3-oxidanylidene-pentanoate

Systemtic Name: 4-[4-(4-bromanyl-2-fluoranyl-phenoxy)phenoxy]-3-oxidanylidene-pentanoate Openeye Name: 4-[4-(4-bromo-2-fluoro-phenoxy)phenoxy]-3-oxo-pentanoate CAS Name: 4-[4-(4-bromo-2-fluorophenoxy)phenoxy]-3-oxopentanoate IUPAC Name: 4-[4-(4-bromo-2-fluorophenoxy)phenoxy]-3-oxopentanoate Traditional Name: 4-[4-(4-bromo-2-fluoro-phenoxy)phenoxy]-3-keto-valerate Formula: C17H13BrFO5- MolecularWeight: 396.184523

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)CC(=O)[O-])OC1=CC=C(C=C1)OC2=C(C=C(C=C2)Br)F

Isomeric SMILES

CC(C(=O)CC(=O)[O-])OC1=CC=C(C=C1)OC2=C(C=C(C=C2)Br)F

InChI

InChI=1S/C17H14BrFO5/c1-10(15(20)9-17(21)22)23-12-3-5-13(6-4-12)24-16-7-2-11(18)8-14(16)19/h2-8,10H,9H2,1H3,(H,21,22)/p-1