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(3-propan-2-yl-1,2,4-oxadiazol-5-yl)methyl 2-[(5S,7R)-3-bromanyl-1-adamantyl]ethanoate

(3-propan-2-yl-1,2,4-oxadiazol-5-yl)methyl 2-[(5S,7R)-3-bromanyl-1-adamantyl]ethanoate

Systemtic Name:(3-propan-2-yl-1,2,4-oxadiazol-5-yl)methyl 2-[(5S,7R)-3-bromanyl-1-adamantyl]ethanoate
Openeye Name:(3-isopropyl-1,2,4-oxadiazol-5-yl)methyl 2-[(5S,7R)-3-bromo-1-adamantyl]acetate
CAS Name:2-[(5S,7R)-3-bromo-1-adamantyl]acetic acid (3-propan-2-yl-1,2,4-oxadiazol-5-yl)methyl ester
IUPAC Name:(3-propan-2-yl-1,2,4-oxadiazol-5-yl)methyl 2-[(5S,7R)-3-bromo-1-adamantyl]acetate
Traditional Name:2-[(5S,7R)-3-bromo-1-adamantyl]acetic acid (3-isopropyl-1,2,4-oxadiazol-5-yl)methyl ester
Formula: C18H25BrN2O3
MolecularWeight: 397.3067
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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NOC(=N1)COC(=O)CC23CC4CC(C2)CC(C4)(C3)Br


Isomeric SMILES

CC(C)C1=NOC(=N1)COC(=O)CC23C[C@H]4C[C@@H](C2)CC(C4)(C3)Br


InChI

InChI=1S/C18H25BrN2O3/c1-11(2)16-20-14(24-21-16)9-23-15(22)8-17-4-12-3-13(5-17)7-18(19,6-12)10-17/h11-13H,3-10H2,1-2H3/t12-,13+,17?,18?


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