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

Systemtic Name: 3-[(3-methylpiperidin-1-yl)methyl]-1-benzothiophene-2-carboxylic acid Openeye Name: 3-[(3-methyl-1-piperidyl)methyl]benzothiophene-2-carboxylic acid CAS Name: 3-[(3-methyl-1-piperidinyl)methyl]-1-benzothiophene-2-carboxylic acid IUPAC Name: 3-[(3-methylpiperidin-1-yl)methyl]-1-benzothiophene-2-carboxylic acid Traditional Name: 3-[(3-methylpiperidino)methyl]benzothiophene-2-carboxylic acid Formula: C16H19NO2S MolecularWeight: 289.39256

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)CC2=C(SC3=CC=CC=C32)C(=O)O

Isomeric SMILES

CC1CCCN(C1)CC2=C(SC3=CC=CC=C32)C(=O)O

InChI

InChI=1S/C16H19NO2S/c1-11-5-4-8-17(9-11)10-13-12-6-2-3-7-14(12)20-15(13)16(18)19/h2-3,6-7,11H,4-5,8-10H2,1H3,(H,18,19)