[(1S)-1-(5-bromanyl-2-oxidanyl-phenyl)propyl]-(4-methylcyclohexyl)azanium

Systemtic Name: [(1S)-1-(5-bromanyl-2-oxidanyl-phenyl)propyl]-(4-methylcyclohexyl)azanium Openeye Name: [(1S)-1-(5-bromo-2-hydroxy-phenyl)propyl]-(4-methylcyclohexyl)ammonium CAS Name: [(1S)-1-(5-bromo-2-hydroxyphenyl)propyl]-(4-methylcyclohexyl)ammonium IUPAC Name: [(1S)-1-(5-bromo-2-hydroxyphenyl)propyl]-(4-methylcyclohexyl)azanium Traditional Name: [(1S)-1-(5-bromo-2-hydroxy-phenyl)propyl]-(4-methylcyclohexyl)ammonium Formula: C16H25BrNO+ MolecularWeight: 327.2798

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=C(C=CC(=C1)Br)O)[NH2+]C2CCC(CC2)C

Isomeric SMILES

CC[C@@H](C1=C(C=CC(=C1)Br)O)[NH2+]C2CCC(CC2)C

InChI

InChI=1S/C16H24BrNO/c1-3-15(14-10-12(17)6-9-16(14)19)18-13-7-4-11(2)5-8-13/h6,9-11,13,15,18-19H,3-5,7-8H2,1-2H3/p+1/t11?,13?,15-/m0/s1