methyl (2S)-2-[(9S)-2-fluoranyl-9H-xanthen-9-yl]-3-oxidanylidene-butanoate

Systemtic Name: methyl (2S)-2-[(9S)-2-fluoranyl-9H-xanthen-9-yl]-3-oxidanylidene-butanoate Openeye Name: methyl (2S)-2-[(9S)-2-fluoro-9H-xanthen-9-yl]-3-oxo-butanoate CAS Name: (2S)-2-[(9S)-2-fluoro-9H-xanthen-9-yl]-3-oxobutanoic acid methyl ester IUPAC Name: methyl (2S)-2-[(9S)-2-fluoro-9H-xanthen-9-yl]-3-oxobutanoate Traditional Name: (2S)-2-[(9S)-2-fluoro-9H-xanthen-9-yl]-3-keto-butyric acid methyl ester Formula: C18H15FO4 MolecularWeight: 314.307703

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(C1C2=CC=CC=C2OC3=C1C=C(C=C3)F)C(=O)OC

Isomeric SMILES

CC(=O)[C@H]([C@H]1C2=CC=CC=C2OC3=C1C=C(C=C3)F)C(=O)OC

InChI

InChI=1S/C18H15FO4/c1-10(20)16(18(21)22-2)17-12-5-3-4-6-14(12)23-15-8-7-11(19)9-13(15)17/h3-9,16-17H,1-2H3/t16-,17+/m1/s1