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

Systemtic Name: [(1S)-1-(5-bromanyl-1-benzofuran-2-yl)ethyl]-[(1R,2S)-2-methylcyclohexyl]azanium Openeye Name: [(1S)-1-(5-bromobenzofuran-2-yl)ethyl]-[(1R,2S)-2-methylcyclohexyl]ammonium CAS Name: [(1S)-1-(5-bromo-2-benzofuranyl)ethyl]-[(1R,2S)-2-methylcyclohexyl]ammonium IUPAC Name: [(1S)-1-(5-bromo-1-benzofuran-2-yl)ethyl]-[(1R,2S)-2-methylcyclohexyl]azanium Traditional Name: [(1S)-1-(5-bromobenzofuran-2-yl)ethyl]-[(1R,2S)-2-methylcyclohexyl]ammonium Formula: C17H23BrNO+ MolecularWeight: 337.27462

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1[NH2+]C(C)C2=CC3=C(O2)C=CC(=C3)Br

Isomeric SMILES

C[C@H]1CCCC[C@H]1[NH2+][C@@H](C)C2=CC3=C(O2)C=CC(=C3)Br

InChI

InChI=1S/C17H22BrNO/c1-11-5-3-4-6-15(11)19-12(2)17-10-13-9-14(18)7-8-16(13)20-17/h7-12,15,19H,3-6H2,1-2H3/p+1/t11-,12-,15+/m0/s1