[(1R)-1-(5-bromanyl-1-benzofuran-2-yl)ethyl]-[(2S)-5-methylhexan-2-yl]azanium

Systemtic Name: [(1R)-1-(5-bromanyl-1-benzofuran-2-yl)ethyl]-[(2S)-5-methylhexan-2-yl]azanium Openeye Name: [(1R)-1-(5-bromobenzofuran-2-yl)ethyl]-[(1S)-1,4-dimethylpentyl]ammonium CAS Name: [(1R)-1-(5-bromo-2-benzofuranyl)ethyl]-[(2S)-5-methylhexan-2-yl]ammonium IUPAC Name: [(1R)-1-(5-bromo-1-benzofuran-2-yl)ethyl]-[(2S)-5-methylhexan-2-yl]azanium Traditional Name: [(1R)-1-(5-bromobenzofuran-2-yl)ethyl]-[(1S)-1,4-dimethylpentyl]ammonium Formula: C17H25BrNO+ MolecularWeight: 339.2905

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(C)[NH2+]C(C)C1=CC2=C(O1)C=CC(=C2)Br

Isomeric SMILES

C[C@@H](CCC(C)C)[NH2+][C@H](C)C1=CC2=C(O1)C=CC(=C2)Br

InChI

InChI=1S/C17H24BrNO/c1-11(2)5-6-12(3)19-13(4)17-10-14-9-15(18)7-8-16(14)20-17/h7-13,19H,5-6H2,1-4H3/p+1/t12-,13+/m0/s1