3-(piperidin-3-ylcarbonylamino)-3-thiophen-2-yl-propanoic acid

Systemtic Name: 3-(piperidin-3-ylcarbonylamino)-3-thiophen-2-yl-propanoic acid Openeye Name: 3-(piperidine-3-carbonylamino)-3-(2-thienyl)propanoic acid CAS Name: 3-[[oxo(3-piperidinyl)methyl]amino]-3-thiophen-2-ylpropanoic acid IUPAC Name: 3-(piperidine-3-carbonylamino)-3-thiophen-2-ylpropanoic acid Traditional Name: 3-(nipecotoylamino)-3-(2-thienyl)propionic acid Formula: C13H18N2O3S MolecularWeight: 282.35862

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CNC1)C(=O)NC(CC(=O)O)C2=CC=CS2

Isomeric SMILES

C1CC(CNC1)C(=O)NC(CC(=O)O)C2=CC=CS2

InChI

InChI=1S/C13H18N2O3S/c16-12(17)7-10(11-4-2-6-19-11)15-13(18)9-3-1-5-14-8-9/h2,4,6,9-10,14H,1,3,5,7-8H2,(H,15,18)(H,16,17)