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

Systemtic Name: [(1S)-1-(5-bromanyl-2-oxidanyl-phenyl)propyl]-[(1R)-1-phenylethyl]azanium Openeye Name: [(1S)-1-(5-bromo-2-hydroxy-phenyl)propyl]-[(1R)-1-phenylethyl]ammonium CAS Name: [(1S)-1-(5-bromo-2-hydroxyphenyl)propyl]-[(1R)-1-phenylethyl]ammonium IUPAC Name: [(1S)-1-(5-bromo-2-hydroxyphenyl)propyl]-[(1R)-1-phenylethyl]azanium Traditional Name: [(1S)-1-(5-bromo-2-hydroxy-phenyl)propyl]-[(1R)-1-phenylethyl]ammonium Formula: C17H21BrNO+ MolecularWeight: 335.25874

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=C(C=CC(=C1)Br)O)[NH2+]C(C)C2=CC=CC=C2

Isomeric SMILES

CC[C@@H](C1=C(C=CC(=C1)Br)O)[NH2+][C@H](C)C2=CC=CC=C2

InChI

InChI=1S/C17H20BrNO/c1-3-16(15-11-14(18)9-10-17(15)20)19-12(2)13-7-5-4-6-8-13/h4-12,16,19-20H,3H2,1-2H3/p+1/t12-,16+/m1/s1