[(1S)-1-(5-bromanyl-2-oxidanyl-phenyl)propyl]-cyclooctyl-azanium

Systemtic Name: [(1S)-1-(5-bromanyl-2-oxidanyl-phenyl)propyl]-cyclooctyl-azanium Openeye Name: [(1S)-1-(5-bromo-2-hydroxy-phenyl)propyl]-cyclooctyl-ammonium CAS Name: [(1S)-1-(5-bromo-2-hydroxyphenyl)propyl]-cyclooctylammonium IUPAC Name: [(1S)-1-(5-bromo-2-hydroxyphenyl)propyl]-cyclooctylazanium Traditional Name: [(1S)-1-(5-bromo-2-hydroxy-phenyl)propyl]-cyclooctyl-ammonium Formula: C17H27BrNO+ MolecularWeight: 341.30638

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=C(C=CC(=C1)Br)O)[NH2+]C2CCCCCCC2

Isomeric SMILES

CC[C@@H](C1=C(C=CC(=C1)Br)O)[NH2+]C2CCCCCCC2

InChI

InChI=1S/C17H26BrNO/c1-2-16(15-12-13(18)10-11-17(15)20)19-14-8-6-4-3-5-7-9-14/h10-12,14,16,19-20H,2-9H2,1H3/p+1/t16-/m0/s1