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

Systemtic Name: [(1S)-1-(5-bromanyl-1-benzofuran-2-yl)ethyl]-[2-(cyclohexen-1-yl)ethyl]azanium Openeye Name: [(1S)-1-(5-bromobenzofuran-2-yl)ethyl]-[2-(cyclohexen-1-yl)ethyl]ammonium CAS Name: [(1S)-1-(5-bromo-2-benzofuranyl)ethyl]-[2-(1-cyclohexenyl)ethyl]ammonium IUPAC Name: [(1S)-1-(5-bromo-1-benzofuran-2-yl)ethyl]-[2-(cyclohexen-1-yl)ethyl]azanium Traditional Name: [(1S)-1-(5-bromobenzofuran-2-yl)ethyl]-[2-(cyclohexen-1-yl)ethyl]ammonium Formula: C18H23BrNO+ MolecularWeight: 349.28532

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(O1)C=CC(=C2)Br)[NH2+]CCC3=CCCCC3

Isomeric SMILES

C[C@@H](C1=CC2=C(O1)C=CC(=C2)Br)[NH2+]CCC3=CCCCC3

InChI

InChI=1S/C18H22BrNO/c1-13(20-10-9-14-5-3-2-4-6-14)18-12-15-11-16(19)7-8-17(15)21-18/h5,7-8,11-13,20H,2-4,6,9-10H2,1H3/p+1/t13-/m0/s1