N-[[1,1-bis(oxidanylidene)-1-benzothiophen-3-yl]methyl]-N-ethyl-ethanamine hydrochloride

Systemtic Name: N-[[1,1-bis(oxidanylidene)-1-benzothiophen-3-yl]methyl]-N-ethyl-ethanamine hydrochloride Openeye Name: N-[(1,1-dioxobenzothiophen-3-yl)methyl]-N-ethyl-ethanamine hydrochloride CAS Name: N-[(1,1-dioxo-1-benzothiophen-3-yl)methyl]-N-ethylethanamine hydrochloride IUPAC Name: N-[(1,1-dioxo-1-benzothiophen-3-yl)methyl]-N-ethylethanamine hydrochloride Traditional Name: (1,1-diketobenzothiophen-3-yl)methyl-diethyl-amine hydrochloride Formula: C13H18ClNO2S MolecularWeight: 287.80552

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC1=CS(=O)(=O)C2=CC=CC=C21.Cl

Isomeric SMILES

CCN(CC)CC1=CS(=O)(=O)C2=CC=CC=C21.Cl

InChI

InChI=1S/C13H17NO2S.ClH/c1-3-14(4-2)9-11-10-17(15,16)13-8-6-5-7-12(11)13;/h5-8,10H,3-4,9H2,1-2H3;1H