ethyl 1-[(5-methyl-1,2-oxazol-3-yl)methylsulfonyl]piperidine-3-carboxylate

Systemtic Name: ethyl 1-[(5-methyl-1,2-oxazol-3-yl)methylsulfonyl]piperidine-3-carboxylate Openeye Name: ethyl 1-[(5-methylisoxazol-3-yl)methylsulfonyl]piperidine-3-carboxylate CAS Name: 1-[(5-methyl-3-isoxazolyl)methylsulfonyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(5-methyl-1,2-oxazol-3-yl)methylsulfonyl]piperidine-3-carboxylate Traditional Name: 1-[(5-methylisoxazol-3-yl)methylsulfonyl]nipecotic acid ethyl ester Formula: C13H20N2O5S MolecularWeight: 316.3733

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)S(=O)(=O)CC2=NOC(=C2)C

Isomeric SMILES

CCOC(=O)C1CCCN(C1)S(=O)(=O)CC2=NOC(=C2)C

InChI

InChI=1S/C13H20N2O5S/c1-3-19-13(16)11-5-4-6-15(8-11)21(17,18)9-12-7-10(2)20-14-12/h7,11H,3-6,8-9H2,1-2H3