ethyl 5-chloranyl-3-[[2,2-dimethoxyethyl(methyl)amino]methyl]-1-benzothiophene-2-carboxylate

Systemtic Name: ethyl 5-chloranyl-3-[[2,2-dimethoxyethyl(methyl)amino]methyl]-1-benzothiophene-2-carboxylate Openeye Name: ethyl 5-chloro-3-[[2,2-dimethoxyethyl(methyl)amino]methyl]benzothiophene-2-carboxylate CAS Name: 5-chloro-3-[[2,2-dimethoxyethyl(methyl)amino]methyl]-1-benzothiophene-2-carboxylic acid ethyl ester IUPAC Name: ethyl 5-chloro-3-[[2,2-dimethoxyethyl(methyl)amino]methyl]-1-benzothiophene-2-carboxylate Traditional Name: 5-chloro-3-[[2,2-dimethoxyethyl(methyl)amino]methyl]benzothiophene-2-carboxylic acid ethyl ester Formula: C17H22ClNO4S MolecularWeight: 371.87888

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(S1)C=CC(=C2)Cl)CN(C)CC(OC)OC

Isomeric SMILES

CCOC(=O)C1=C(C2=C(S1)C=CC(=C2)Cl)CN(C)CC(OC)OC

InChI

InChI=1S/C17H22ClNO4S/c1-5-23-17(20)16-13(9-19(2)10-15(21-3)22-4)12-8-11(18)6-7-14(12)24-16/h6-8,15H,5,9-10H2,1-4H3