3-(dimethylamino)propyl 4-[3-(3-acetyloxy-4-ethanoyl-2-propyl-phenoxy)propoxy]-3-fluoranyl-benzoate

Systemtic Name: 3-(dimethylamino)propyl 4-[3-(3-acetyloxy-4-ethanoyl-2-propyl-phenoxy)propoxy]-3-fluoranyl-benzoate Openeye Name: 3-(dimethylamino)propyl 4-[3-(3-acetoxy-4-acetyl-2-propyl-phenoxy)propoxy]-3-fluoro-benzoate CAS Name: 4-[3-(4-acetyl-3-acetyloxy-2-propylphenoxy)propoxy]-3-fluorobenzoic acid 3-(dimethylamino)propyl ester IUPAC Name: 3-(dimethylamino)propyl 4-[3-(4-acetyl-3-acetyloxy-2-propylphenoxy)propoxy]-3-fluorobenzoate Traditional Name: 4-[3-(3-acetoxy-4-acetyl-2-propyl-phenoxy)propoxy]-3-fluoro-benzoic acid 3-(dimethylamino)propyl ester Formula: C28H36FNO7 MolecularWeight: 517.586343

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1OC(=O)C)C(=O)C)OCCCOC2=C(C=C(C=C2)C(=O)OCCCN(C)C)F

Isomeric SMILES

CCCC1=C(C=CC(=C1OC(=O)C)C(=O)C)OCCCOC2=C(C=C(C=C2)C(=O)OCCCN(C)C)F

InChI

InChI=1S/C28H36FNO7/c1-6-9-23-25(13-11-22(19(2)31)27(23)37-20(3)32)34-16-8-17-35-26-12-10-21(18-24(26)29)28(33)36-15-7-14-30(4)5/h10-13,18H,6-9,14-17H2,1-5H3