1-(4-ethyl-5-propyl-thiophen-2-yl)carbonylpiperidine-3-carboxylic acid

Systemtic Name: 1-(4-ethyl-5-propyl-thiophen-2-yl)carbonylpiperidine-3-carboxylic acid Openeye Name: 1-(4-ethyl-5-propyl-thiophene-2-carbonyl)piperidine-3-carboxylic acid CAS Name: 1-[(4-ethyl-5-propyl-2-thiophenyl)-oxomethyl]-3-piperidinecarboxylic acid IUPAC Name: 1-(4-ethyl-5-propylthiophene-2-carbonyl)piperidine-3-carboxylic acid Traditional Name: 1-(4-ethyl-5-propyl-thiophene-2-carbonyl)nipecotic acid Formula: C16H23NO3S MolecularWeight: 309.42372

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=C(S1)C(=O)N2CCCC(C2)C(=O)O)CC

Isomeric SMILES

CCCC1=C(C=C(S1)C(=O)N2CCCC(C2)C(=O)O)CC

InChI

InChI=1S/C16H23NO3S/c1-3-6-13-11(4-2)9-14(21-13)15(18)17-8-5-7-12(10-17)16(19)20/h9,12H,3-8,10H2,1-2H3,(H,19,20)