1-[(1-methylimidazol-2-yl)-thiophen-2-yl-methyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[(1-methylimidazol-2-yl)-thiophen-2-yl-methyl]piperidine-4-carboxylic acid Openeye Name: 1-[(1-methylimidazol-2-yl)-(2-thienyl)methyl]piperidine-4-carboxylic acid CAS Name: 1-[(1-methyl-2-imidazolyl)-thiophen-2-ylmethyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[(1-methylimidazol-2-yl)-thiophen-2-ylmethyl]piperidine-4-carboxylic acid Traditional Name: 1-[(1-methylimidazol-2-yl)-(2-thienyl)methyl]isonipecotic acid Formula: C15H19N3O2S MolecularWeight: 305.39526

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1C(C2=CC=CS2)N3CCC(CC3)C(=O)O

Isomeric SMILES

CN1C=CN=C1C(C2=CC=CS2)N3CCC(CC3)C(=O)O

InChI

InChI=1S/C15H19N3O2S/c1-17-9-6-16-14(17)13(12-3-2-10-21-12)18-7-4-11(5-8-18)15(19)20/h2-3,6,9-11,13H,4-5,7-8H2,1H3,(H,19,20)