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[(2S)-2-[(2S,4aS,8aR)-3,4,4a,5,6,7,8,8a-octahydro-2H-chromen-2-yl]-2-oxidanyl-ethyl] 2,4-bis(chloranyl)benzoate

[(2S)-2-[(2S,4aS,8aR)-3,4,4a,5,6,7,8,8a-octahydro-2H-chromen-2-yl]-2-oxidanyl-ethyl] 2,4-bis(chloranyl)benzoate

Systemtic Name:[(2S)-2-[(2S,4aS,8aR)-3,4,4a,5,6,7,8,8a-octahydro-2H-chromen-2-yl]-2-oxidanyl-ethyl] 2,4-bis(chloranyl)benzoate
Openeye Name:[(2S)-2-[(2S,4aS,8aR)-3,4,4a,5,6,7,8,8a-octahydro-2H-chromen-2-yl]-2-hydroxy-ethyl] 2,4-dichlorobenzoate
CAS Name:2,4-dichlorobenzoic acid [(2S)-2-[(2S,4aS,8aR)-3,4,4a,5,6,7,8,8a-octahydro-2H-1-benzopyran-2-yl]-2-hydroxyethyl] ester
IUPAC Name:[(2S)-2-[(2S,4aS,8aR)-3,4,4a,5,6,7,8,8a-octahydro-2H-chromen-2-yl]-2-hydroxyethyl] 2,4-dichlorobenzoate
Traditional Name:2,4-dichlorobenzoic acid [(2S)-2-[(2S,4aS,8aR)-3,4,4a,5,6,7,8,8a-octahydro-2H-chromen-2-yl]-2-hydroxy-ethyl] ester
Formula: C18H22Cl2O4
MolecularWeight: 373.27088
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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2C(C1)CCC(O2)C(COC(=O)C3=C(C=C(C=C3)Cl)Cl)O


Isomeric SMILES

C1CC[C@@H]2[C@@H](C1)CC[C@H](O2)[C@H](COC(=O)C3=C(C=C(C=C3)Cl)Cl)O


InChI

InChI=1S/C18H22Cl2O4/c19-12-6-7-13(14(20)9-12)18(22)23-10-15(21)17-8-5-11-3-1-2-4-16(11)24-17/h6-7,9,11,15-17,21H,1-5,8,10H2/t11-,15-,16+,17-/m0/s1


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