1-(4,5-dimethylthiophen-2-yl)carbonylpiperidine-4-carboxylic acid

Systemtic Name: 1-(4,5-dimethylthiophen-2-yl)carbonylpiperidine-4-carboxylic acid Openeye Name: 1-(4,5-dimethylthiophene-2-carbonyl)piperidine-4-carboxylic acid CAS Name: 1-[(4,5-dimethyl-2-thiophenyl)-oxomethyl]-4-piperidinecarboxylic acid IUPAC Name: 1-(4,5-dimethylthiophene-2-carbonyl)piperidine-4-carboxylic acid Traditional Name: 1-(4,5-dimethylthiophene-2-carbonyl)isonipecotic acid Formula: C13H17NO3S MolecularWeight: 267.34398

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17NO3S/c1-8-7-11(18-9(8)2)12(15)14-5-3-10(4-6-14)13(16)17/h7,10H,3-6H2,1-2H3,(H,16,17)