ethyl 2-[(4-fluoranyl-3-octoxy-phenyl)carbamoyloxy]-3-methyl-but-3-enoate

Systemtic Name: ethyl 2-[(4-fluoranyl-3-octoxy-phenyl)carbamoyloxy]-3-methyl-but-3-enoate Openeye Name: ethyl 2-[(4-fluoro-3-octoxy-phenyl)carbamoyloxy]-3-methyl-but-3-enoate CAS Name: 2-[(4-fluoro-3-octoxyanilino)-oxomethoxy]-3-methyl-3-butenoic acid ethyl ester IUPAC Name: ethyl 2-[(4-fluoro-3-octoxyphenyl)carbamoyloxy]-3-methylbut-3-enoate Traditional Name: 2-[(4-fluoro-3-octoxy-phenyl)carbamoyloxy]-3-methyl-but-3-enoic acid ethyl ester Formula: C22H32FNO5 MolecularWeight: 409.491583

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=C(C=CC(=C1)NC(=O)OC(C(=C)C)C(=O)OCC)F

Isomeric SMILES

CCCCCCCCOC1=C(C=CC(=C1)NC(=O)OC(C(=C)C)C(=O)OCC)F

InChI

InChI=1S/C22H32FNO5/c1-5-7-8-9-10-11-14-28-19-15-17(12-13-18(19)23)24-22(26)29-20(16(3)4)21(25)27-6-2/h12-13,15,20H,3,5-11,14H2,1-2,4H3,(H,24,26)