1-(3-methylthiophen-2-yl)carbonylpiperidine-4-carboxylic acid

Systemtic Name: 1-(3-methylthiophen-2-yl)carbonylpiperidine-4-carboxylic acid Openeye Name: 1-(3-methylthiophene-2-carbonyl)piperidine-4-carboxylic acid CAS Name: 1-[(3-methyl-2-thiophenyl)-oxomethyl]-4-piperidinecarboxylic acid IUPAC Name: 1-(3-methylthiophene-2-carbonyl)piperidine-4-carboxylic acid Traditional Name: 1-(3-methylthiophene-2-carbonyl)isonipecotic acid Formula: C12H15NO3S MolecularWeight: 253.3174

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C(=O)N2CCC(CC2)C(=O)O

Isomeric SMILES

CC1=C(SC=C1)C(=O)N2CCC(CC2)C(=O)O

InChI

InChI=1S/C12H15NO3S/c1-8-4-7-17-10(8)11(14)13-5-2-9(3-6-13)12(15)16/h4,7,9H,2-3,5-6H2,1H3,(H,15,16)