3-(dimethylaminomethyl)-3-ethyl-2-benzothiophen-1-one hydrochloride

Systemtic Name: 3-(dimethylaminomethyl)-3-ethyl-2-benzothiophen-1-one hydrochloride Openeye Name: 3-(dimethylaminomethyl)-3-ethyl-2-benzothiophen-1-one hydrochloride CAS Name: 3-(dimethylaminomethyl)-3-ethyl-2-benzothiophen-1-one hydrochloride IUPAC Name: 3-(dimethylaminomethyl)-3-ethyl-2-benzothiophen-1-one hydrochloride Traditional Name: 3-(dimethylaminomethyl)-3-ethyl-isobenzothiophen-1-one hydrochloride Formula: C13H18ClNOS MolecularWeight: 271.80612

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C2=CC=CC=C2C(=O)S1)CN(C)C.Cl

Isomeric SMILES

CCC1(C2=CC=CC=C2C(=O)S1)CN(C)C.Cl

InChI

InChI=1S/C13H17NOS.ClH/c1-4-13(9-14(2)3)11-8-6-5-7-10(11)12(15)16-13;/h5-8H,4,9H2,1-3H3;1H