1-(5-ethylthiophen-2-yl)carbonylpiperidine-3-carboxylic acid

Systemtic Name: 1-(5-ethylthiophen-2-yl)carbonylpiperidine-3-carboxylic acid Openeye Name: 1-(5-ethylthiophene-2-carbonyl)piperidine-3-carboxylic acid CAS Name: 1-[(5-ethyl-2-thiophenyl)-oxomethyl]-3-piperidinecarboxylic acid IUPAC Name: 1-(5-ethylthiophene-2-carbonyl)piperidine-3-carboxylic acid Traditional Name: 1-(5-ethylthiophene-2-carbonyl)nipecotic acid Formula: C13H17NO3S MolecularWeight: 267.34398

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(S1)C(=O)N2CCCC(C2)C(=O)O

Isomeric SMILES

CCC1=CC=C(S1)C(=O)N2CCCC(C2)C(=O)O

InChI

InChI=1S/C13H17NO3S/c1-2-10-5-6-11(18-10)12(15)14-7-3-4-9(8-14)13(16)17/h5-6,9H,2-4,7-8H2,1H3,(H,16,17)