1-[(5-ethylthiophen-2-yl)-pyridin-2-yl-methyl]piperidine-2-carboxylic acid

Systemtic Name: 1-[(5-ethylthiophen-2-yl)-pyridin-2-yl-methyl]piperidine-2-carboxylic acid Openeye Name: 1-[(5-ethyl-2-thienyl)-(2-pyridyl)methyl]piperidine-2-carboxylic acid CAS Name: 1-[(5-ethyl-2-thiophenyl)-(2-pyridinyl)methyl]-2-piperidinecarboxylic acid IUPAC Name: 1-[(5-ethylthiophen-2-yl)-pyridin-2-ylmethyl]piperidine-2-carboxylic acid Traditional Name: 1-[(5-ethyl-2-thienyl)-(2-pyridyl)methyl]pipecolinic acid Formula: C18H22N2O2S MolecularWeight: 330.44448

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(S1)C(C2=CC=CC=N2)N3CCCCC3C(=O)O

Isomeric SMILES

CCC1=CC=C(S1)C(C2=CC=CC=N2)N3CCCCC3C(=O)O

InChI

InChI=1S/C18H22N2O2S/c1-2-13-9-10-16(23-13)17(14-7-3-5-11-19-14)20-12-6-4-8-15(20)18(21)22/h3,5,7,9-11,15,17H,2,4,6,8,12H2,1H3,(H,21,22)