2-[2-[(5R,7R)-3-bromanyl-1-adamantyl]ethanoyloxy]ethyl-dimethyl-azanium

Systemtic Name: 2-[2-[(5R,7R)-3-bromanyl-1-adamantyl]ethanoyloxy]ethyl-dimethyl-azanium Openeye Name: 2-[2-[(5R,7R)-3-bromo-1-adamantyl]acetyl]oxyethyl-dimethyl-ammonium CAS Name: 2-[2-[(5R,7R)-3-bromo-1-adamantyl]-1-oxoethoxy]ethyl-dimethylammonium IUPAC Name: 2-[2-[(5R,7R)-3-bromo-1-adamantyl]acetyl]oxyethyl-dimethylazanium Traditional Name: 2-[2-[(5R,7R)-3-bromo-1-adamantyl]acetyl]oxyethyl-dimethyl-ammonium Formula: C16H27BrNO2+ MolecularWeight: 345.29508

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCOC(=O)CC12CC3CC(C1)CC(C3)(C2)Br

Isomeric SMILES

C[NH+](C)CCOC(=O)CC12C[C@H]3C[C@H](C1)CC(C3)(C2)Br

InChI

InChI=1S/C16H26BrNO2/c1-18(2)3-4-20-14(19)10-15-6-12-5-13(7-15)9-16(17,8-12)11-15/h12-13H,3-11H2,1-2H3/p+1/t12-,13-,15?,16?/m1/s1