2-(1-oxidanylideneisochromen-3-yl)ethyl 4-fluoranylbenzoate

Systemtic Name: 2-(1-oxidanylideneisochromen-3-yl)ethyl 4-fluoranylbenzoate Openeye Name: 2-(1-oxoisochromen-3-yl)ethyl 4-fluorobenzoate CAS Name: 4-fluorobenzoic acid 2-(1-oxo-2-benzopyran-3-yl)ethyl ester IUPAC Name: 2-(1-oxoisochromen-3-yl)ethyl 4-fluorobenzoate Traditional Name: 4-fluorobenzoic acid 2-(1-ketoisochromen-3-yl)ethyl ester Formula: C18H13FO4 MolecularWeight: 312.291823

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(OC2=O)CCOC(=O)C3=CC=C(C=C3)F

Isomeric SMILES

C1=CC=C2C(=C1)C=C(OC2=O)CCOC(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C18H13FO4/c19-14-7-5-12(6-8-14)17(20)22-10-9-15-11-13-3-1-2-4-16(13)18(21)23-15/h1-8,11H,9-10H2