3-(diethylaminomethyl)-1-benzothiophene-2-carboxylic acid

Systemtic Name: 3-(diethylaminomethyl)-1-benzothiophene-2-carboxylic acid Openeye Name: 3-(diethylaminomethyl)benzothiophene-2-carboxylic acid CAS Name: 3-(diethylaminomethyl)-1-benzothiophene-2-carboxylic acid IUPAC Name: 3-(diethylaminomethyl)-1-benzothiophene-2-carboxylic acid Traditional Name: 3-(diethylaminomethyl)benzothiophene-2-carboxylic acid Formula: C14H17NO2S MolecularWeight: 263.35528

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC1=C(SC2=CC=CC=C21)C(=O)O

Isomeric SMILES

CCN(CC)CC1=C(SC2=CC=CC=C21)C(=O)O

InChI

InChI=1S/C14H17NO2S/c1-3-15(4-2)9-11-10-7-5-6-8-12(10)18-13(11)14(16)17/h5-8H,3-4,9H2,1-2H3,(H,16,17)