ethyl (1S,6R)-6-methyl-4-(1,2-oxazol-3-ylamino)-2-oxidanylidene-cyclohex-3-ene-1-carboxylate

Systemtic Name: ethyl (1S,6R)-6-methyl-4-(1,2-oxazol-3-ylamino)-2-oxidanylidene-cyclohex-3-ene-1-carboxylate Openeye Name: ethyl (1S,6R)-4-(isoxazol-3-ylamino)-6-methyl-2-oxo-cyclohex-3-ene-1-carboxylate CAS Name: (1S,6R)-4-(3-isoxazolylamino)-6-methyl-2-oxo-1-cyclohex-3-enecarboxylic acid ethyl ester IUPAC Name: ethyl (1S,6R)-6-methyl-4-(1,2-oxazol-3-ylamino)-2-oxocyclohex-3-ene-1-carboxylate Traditional Name: (1S,6R)-4-(isoxazol-3-ylamino)-2-keto-6-methyl-cyclohex-3-ene-1-carboxylic acid ethyl ester Formula: C13H16N2O4 MolecularWeight: 264.27714

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(CC(=CC1=O)NC2=NOC=C2)C

Isomeric SMILES

CCOC(=O)[C@H]1[C@@H](CC(=CC1=O)NC2=NOC=C2)C

InChI

InChI=1S/C13H16N2O4/c1-3-18-13(17)12-8(2)6-9(7-10(12)16)14-11-4-5-19-15-11/h4-5,7-8,12H,3,6H2,1-2H3,(H,14,15)/t8-,12+/m1/s1