ethyl 5-[3,5-bis(fluoranyl)phenyl]pent-4-ynoate

Systemtic Name: ethyl 5-[3,5-bis(fluoranyl)phenyl]pent-4-ynoate Openeye Name: ethyl 5-(3,5-difluorophenyl)pent-4-ynoate CAS Name: 5-(3,5-difluorophenyl)-4-pentynoic acid ethyl ester IUPAC Name: ethyl 5-(3,5-difluorophenyl)pent-4-ynoate Traditional Name: 5-(3,5-difluorophenyl)pent-4-ynoic acid ethyl ester Formula: C13H12F2O2 MolecularWeight: 238.229986

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC#CC1=CC(=CC(=C1)F)F

Isomeric SMILES

CCOC(=O)CCC#CC1=CC(=CC(=C1)F)F

InChI

InChI=1S/C13H12F2O2/c1-2-17-13(16)6-4-3-5-10-7-11(14)9-12(15)8-10/h7-9H,2,4,6H2,1H3