(4-bromanylthiophen-2-yl)methyl-[(4S)-4,5,6,7-tetrahydro-1-benzofuran-4-yl]azanium

Systemtic Name: (4-bromanylthiophen-2-yl)methyl-[(4S)-4,5,6,7-tetrahydro-1-benzofuran-4-yl]azanium Openeye Name: (4-bromo-2-thienyl)methyl-[(4S)-4,5,6,7-tetrahydrobenzofuran-4-yl]ammonium CAS Name: (4-bromo-2-thiophenyl)methyl-[(4S)-4,5,6,7-tetrahydrobenzofuran-4-yl]ammonium IUPAC Name: (4-bromothiophen-2-yl)methyl-[(4S)-4,5,6,7-tetrahydro-1-benzofuran-4-yl]azanium Traditional Name: (4-bromo-2-thienyl)methyl-[(4S)-4,5,6,7-tetrahydrobenzofuran-4-yl]ammonium Formula: C13H15BrNOS+ MolecularWeight: 313.2333

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(C2=C(C1)OC=C2)[NH2+]CC3=CC(=CS3)Br

Isomeric SMILES

C1C[C@@H](C2=C(C1)OC=C2)[NH2+]CC3=CC(=CS3)Br

InChI

InChI=1S/C13H14BrNOS/c14-9-6-10(17-8-9)7-15-12-2-1-3-13-11(12)4-5-16-13/h4-6,8,12,15H,1-3,7H2/p+1/t12-/m0/s1