tert-butyl 5-[(2-chloranyl-6-fluoranyl-phenyl)methoxy]-4-oxidanylidene-3-(prop-2-enoxycarbonylamino)pentanoate

Systemtic Name: tert-butyl 5-[(2-chloranyl-6-fluoranyl-phenyl)methoxy]-4-oxidanylidene-3-(prop-2-enoxycarbonylamino)pentanoate Openeye Name: tert-butyl 3-(allyloxycarbonylamino)-5-[(2-chloro-6-fluoro-phenyl)methoxy]-4-oxo-pentanoate CAS Name: 5-[(2-chloro-6-fluorophenyl)methoxy]-4-oxo-3-[[oxo(prop-2-enoxy)methyl]amino]pentanoic acid tert-butyl ester IUPAC Name: tert-butyl 5-[(2-chloro-6-fluorophenyl)methoxy]-4-oxo-3-(prop-2-enoxycarbonylamino)pentanoate Traditional Name: 3-(allyloxycarbonylamino)-5-(2-chloro-6-fluoro-benzyl)oxy-4-keto-valeric acid tert-butyl ester Formula: C20H25ClFNO6 MolecularWeight: 429.867003

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CC(C(=O)COCC1=C(C=CC=C1Cl)F)NC(=O)OCC=C

Isomeric SMILES

CC(C)(C)OC(=O)CC(C(=O)COCC1=C(C=CC=C1Cl)F)NC(=O)OCC=C

InChI

InChI=1S/C20H25ClFNO6/c1-5-9-28-19(26)23-16(10-18(25)29-20(2,3)4)17(24)12-27-11-13-14(21)7-6-8-15(13)22/h5-8,16H,1,9-12H2,2-4H3,(H,23,26)