(3S)-1-[2-[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]ethanoyl]piperidine-3-carboxylate

Systemtic Name: (3S)-1-[2-[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]ethanoyl]piperidine-3-carboxylate Openeye Name: (3S)-1-[2-[2-(4-methoxyphenyl)thiazol-4-yl]acetyl]piperidine-3-carboxylate CAS Name: (3S)-1-[2-[2-(4-methoxyphenyl)-4-thiazolyl]-1-oxoethyl]-3-piperidinecarboxylate IUPAC Name: (3S)-1-[2-[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]acetyl]piperidine-3-carboxylate Traditional Name: (3S)-1-[2-[2-(4-methoxyphenyl)thiazol-4-yl]acetyl]nipecotate Formula: C18H19N2O4S- MolecularWeight: 359.41946

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NC(=CS2)CC(=O)N3CCCC(C3)C(=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)C2=NC(=CS2)CC(=O)N3CCC[C@@H](C3)C(=O)[O-]

InChI

InChI=1S/C18H20N2O4S/c1-24-15-6-4-12(5-7-15)17-19-14(11-25-17)9-16(21)20-8-2-3-13(10-20)18(22)23/h4-7,11,13H,2-3,8-10H2,1H3,(H,22,23)/p-1/t13-/m0/s1