[(1R)-1-(5-bromanyl-2-oxidanyl-phenyl)propyl]-pentyl-azanium

Systemtic Name: [(1R)-1-(5-bromanyl-2-oxidanyl-phenyl)propyl]-pentyl-azanium Openeye Name: [(1R)-1-(5-bromo-2-hydroxy-phenyl)propyl]-pentyl-ammonium CAS Name: [(1R)-1-(5-bromo-2-hydroxyphenyl)propyl]-pentylammonium IUPAC Name: [(1R)-1-(5-bromo-2-hydroxyphenyl)propyl]-pentylazanium Traditional Name: amyl-[(1R)-1-(5-bromo-2-hydroxy-phenyl)propyl]ammonium Formula: C14H23BrNO+ MolecularWeight: 301.24252

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H22BrNO/c1-3-5-6-9-16-13(4-2)12-10-11(15)7-8-14(12)17/h7-8,10,13,16-17H,3-6,9H2,1-2H3/p+1/t13-/m1/s1