2-ethyl-2,3-dihydro-1-benzofuran; 1-thiomorpholin-4-id-3-ylethanone

Systemtic Name: 2-ethyl-2,3-dihydro-1-benzofuran; 1-thiomorpholin-4-id-3-ylethanone Openeye Name: 2-ethyl-2,3-dihydrobenzofuran; 1-thiomorpholin-4-id-3-ylethanone CAS Name: 2-ethyl-2,3-dihydrobenzofuran; 1-(3-thiomorpholin-4-idyl)ethanone IUPAC Name: 2-ethyl-2,3-dihydro-1-benzofuran; 1-thiomorpholin-4-id-3-ylethanone Traditional Name: 2-ethylcoumaran; 1-thiomorpholin-4-id-3-ylethanone Formula: C16H22NO2S- MolecularWeight: 292.41638

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1CC2=CC=CC=C2O1.CC(=O)C1CSCC[N-]1

Isomeric SMILES

CCC1CC2=CC=CC=C2O1.CC(=O)C1CSCC[N-]1

InChI

InChI=1S/C10H12O.C6H10NOS/c1-2-9-7-8-5-3-4-6-10(8)11-9;1-5(8)6-4-9-3-2-7-6/h3-6,9H,2,7H2,1H3;6H,2-4H2,1H3/q;-1