5-[(3-methylpiperidin-1-yl)methyl]thiophene-2-carboxylic acid

Systemtic Name: 5-[(3-methylpiperidin-1-yl)methyl]thiophene-2-carboxylic acid Openeye Name: 5-[(3-methyl-1-piperidyl)methyl]thiophene-2-carboxylic acid CAS Name: 5-[(3-methyl-1-piperidinyl)methyl]-2-thiophenecarboxylic acid IUPAC Name: 5-[(3-methylpiperidin-1-yl)methyl]thiophene-2-carboxylic acid Traditional Name: 5-[(3-methylpiperidino)methyl]-2-thenoic acid Formula: C12H17NO2S MolecularWeight: 239.33388

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)CC2=CC=C(S2)C(=O)O

Isomeric SMILES

CC1CCCN(C1)CC2=CC=C(S2)C(=O)O

InChI

InChI=1S/C12H17NO2S/c1-9-3-2-6-13(7-9)8-10-4-5-11(16-10)12(14)15/h4-5,9H,2-3,6-8H2,1H3,(H,14,15)