2-[[(1S,3S,4R)-7,7-dimethyl-4-[(2-oxidanylidene-1,3-oxazol-3-yl)carbonyl]-3-bicyclo[2.2.1]heptanyl]oxy]ethyl (E)-2,2-bis(chloranyl)hex-4-enoate

Systemtic Name: 2-[[(1S,3S,4R)-7,7-dimethyl-4-[(2-oxidanylidene-1,3-oxazol-3-yl)carbonyl]-3-bicyclo[2.2.1]heptanyl]oxy]ethyl (E)-2,2-bis(chloranyl)hex-4-enoate Openeye Name: 2-[(1R,2S,4S)-7,7-dimethyl-1-(2-oxooxazole-3-carbonyl)norbornan-2-yl]oxyethyl (E)-2,2-dichlorohex-4-enoate CAS Name: (E)-2,2-dichloro-4-hexenoic acid 2-[[(1S,3S,4R)-7,7-dimethyl-4-[oxo-(2-oxo-3-oxazolyl)methyl]-3-bicyclo[2.2.1]heptanyl]oxy]ethyl ester IUPAC Name: 2-[[(1S,3S,4R)-7,7-dimethyl-4-(2-oxo-1,3-oxazole-3-carbonyl)-3-bicyclo[2.2.1]heptanyl]oxy]ethyl (E)-2,2-dichlorohex-4-enoate Traditional Name: (E)-2,2-dichlorohex-4-enoic acid 2-[(1R,2S,4S)-1-(2-keto-4-oxazoline-3-carbonyl)-7,7-dimethyl-norbornan-2-yl]oxyethyl ester Formula: C21H27Cl2NO6 MolecularWeight: 460.34818

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Descriptors Computed from Structure

Canonical SMILES:

CC=CCC(C(=O)OCCOC1CC2CCC1(C2(C)C)C(=O)N3C=COC3=O)(Cl)Cl

Isomeric SMILES

C/C=C/CC(C(=O)OCCO[C@H]1C[C@@H]2CC[C@]1(C2(C)C)C(=O)N3C=COC3=O)(Cl)Cl

InChI

InChI=1S/C21H27Cl2NO6/c1-4-5-7-21(22,23)17(26)29-12-11-28-15-13-14-6-8-20(15,19(14,2)3)16(25)24-9-10-30-18(24)27/h4-5,9-10,14-15H,6-8,11-13H2,1-3H3/b5-4+/t14-,15-,20+/m0/s1