[(S)-(5-bromanylpyridin-3-yl)-(4-propan-2-yloxyphenyl)methyl]azanium

Systemtic Name: [(S)-(5-bromanylpyridin-3-yl)-(4-propan-2-yloxyphenyl)methyl]azanium Openeye Name: [(S)-(5-bromo-3-pyridyl)-(4-isopropoxyphenyl)methyl]ammonium CAS Name: [(S)-(5-bromo-3-pyridinyl)-(4-propan-2-yloxyphenyl)methyl]ammonium IUPAC Name: [(S)-(5-bromopyridin-3-yl)-(4-propan-2-yloxyphenyl)methyl]azanium Traditional Name: [(S)-(5-bromo-3-pyridyl)-(4-isopropoxyphenyl)methyl]ammonium Formula: C15H18BrN2O+ MolecularWeight: 322.22022

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)C(C2=CC(=CN=C2)Br)[NH3+]

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)[C@@H](C2=CC(=CN=C2)Br)[NH3+]

InChI

InChI=1S/C15H17BrN2O/c1-10(2)19-14-5-3-11(4-6-14)15(17)12-7-13(16)9-18-8-12/h3-10,15H,17H2,1-2H3/p+1/t15-/m0/s1