13-(4-chloranyl-5-oxidanylidene-2H-1,2-oxazol-3-yl)tridecyl 2,2-dimethylpropanoate

Systemtic Name: 13-(4-chloranyl-5-oxidanylidene-2H-1,2-oxazol-3-yl)tridecyl 2,2-dimethylpropanoate Openeye Name: 13-(4-chloro-5-oxo-2H-isoxazol-3-yl)tridecyl 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid 13-(4-chloro-5-oxo-2H-isoxazol-3-yl)tridecyl ester IUPAC Name: 13-(4-chloro-5-oxo-2H-1,2-oxazol-3-yl)tridecyl 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid 13-(4-chloro-5-keto-3-isoxazolin-3-yl)tridecyl ester Formula: C21H36ClNO4 MolecularWeight: 401.96784

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)OCCCCCCCCCCCCCC1=C(C(=O)ON1)Cl

Isomeric SMILES

CC(C)(C)C(=O)OCCCCCCCCCCCCCC1=C(C(=O)ON1)Cl

InChI

InChI=1S/C21H36ClNO4/c1-21(2,3)20(25)26-16-14-12-10-8-6-4-5-7-9-11-13-15-17-18(22)19(24)27-23-17/h23H,4-16H2,1-3H3