propyl 4-(5-butyl-1,3-dioxan-2-yl)-3-fluoranyl-benzoate

Systemtic Name: propyl 4-(5-butyl-1,3-dioxan-2-yl)-3-fluoranyl-benzoate Openeye Name: propyl 4-(5-butyl-1,3-dioxan-2-yl)-3-fluoro-benzoate CAS Name: 4-(5-butyl-1,3-dioxan-2-yl)-3-fluorobenzoic acid propyl ester IUPAC Name: propyl 4-(5-butyl-1,3-dioxan-2-yl)-3-fluorobenzoate Traditional Name: 4-(5-butyl-1,3-dioxan-2-yl)-3-fluoro-benzoic acid propyl ester Formula: C18H25FO4 MolecularWeight: 324.387103

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1COC(OC1)C2=C(C=C(C=C2)C(=O)OCCC)F

Isomeric SMILES

CCCCC1COC(OC1)C2=C(C=C(C=C2)C(=O)OCCC)F

InChI

InChI=1S/C18H25FO4/c1-3-5-6-13-11-22-18(23-12-13)15-8-7-14(10-16(15)19)17(20)21-9-4-2/h7-8,10,13,18H,3-6,9,11-12H2,1-2H3