3-[(3-ethylpiperidin-1-yl)methyl]-1-benzothiophene-2-carboxylic acid

Systemtic Name: 3-[(3-ethylpiperidin-1-yl)methyl]-1-benzothiophene-2-carboxylic acid Openeye Name: 3-[(3-ethyl-1-piperidyl)methyl]benzothiophene-2-carboxylic acid CAS Name: 3-[(3-ethyl-1-piperidinyl)methyl]-1-benzothiophene-2-carboxylic acid IUPAC Name: 3-[(3-ethylpiperidin-1-yl)methyl]-1-benzothiophene-2-carboxylic acid Traditional Name: 3-[(3-ethylpiperidino)methyl]benzothiophene-2-carboxylic acid Formula: C17H21NO2S MolecularWeight: 303.41914

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCN(C1)CC2=C(SC3=CC=CC=C32)C(=O)O

Isomeric SMILES

CCC1CCCN(C1)CC2=C(SC3=CC=CC=C32)C(=O)O

InChI

InChI=1S/C17H21NO2S/c1-2-12-6-5-9-18(10-12)11-14-13-7-3-4-8-15(13)21-16(14)17(19)20/h3-4,7-8,12H,2,5-6,9-11H2,1H3,(H,19,20)