[(2R)-5-ethoxy-3-oxidanylidene-1-benzothiophen-2-yl]methylidene-pentyl-azanium

Systemtic Name: [(2R)-5-ethoxy-3-oxidanylidene-1-benzothiophen-2-yl]methylidene-pentyl-azanium Openeye Name: [(2R)-5-ethoxy-3-oxo-benzothiophen-2-yl]methylene-pentyl-ammonium CAS Name: [(2R)-5-ethoxy-3-oxo-1-benzothiophen-2-yl]methylidene-pentylammonium IUPAC Name: [(2R)-5-ethoxy-3-oxo-1-benzothiophen-2-yl]methylidene-pentylazanium Traditional Name: amyl-[[(2R)-5-ethoxy-3-keto-benzothiophen-2-yl]methylene]ammonium Formula: C16H22NO2S+ MolecularWeight: 292.41638

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC[NH+]=CC1C(=O)C2=C(S1)C=CC(=C2)OCC

Isomeric SMILES

CCCCC[NH+]=C[C@@H]1C(=O)C2=C(S1)C=CC(=C2)OCC

InChI

InChI=1S/C16H21NO2S/c1-3-5-6-9-17-11-15-16(18)13-10-12(19-4-2)7-8-14(13)20-15/h7-8,10-11,15H,3-6,9H2,1-2H3/p+1/t15-/m1/s1