[2-oxidanylidene-2-(2-phenylbutylamino)ethyl] 5-azanyl-3-methyl-1,2-oxazole-4-carboxylate

Systemtic Name: [2-oxidanylidene-2-(2-phenylbutylamino)ethyl] 5-azanyl-3-methyl-1,2-oxazole-4-carboxylate Openeye Name: [2-oxo-2-(2-phenylbutylamino)ethyl] 5-amino-3-methyl-isoxazole-4-carboxylate CAS Name: 5-amino-3-methyl-4-isoxazolecarboxylic acid [2-oxo-2-(2-phenylbutylamino)ethyl] ester IUPAC Name: [2-oxo-2-(2-phenylbutylamino)ethyl] 5-amino-3-methyl-1,2-oxazole-4-carboxylate Traditional Name: 5-amino-3-methyl-isoxazole-4-carboxylic acid [2-keto-2-(2-phenylbutylamino)ethyl] ester Formula: C17H21N3O4 MolecularWeight: 331.36634

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CNC(=O)COC(=O)C1=C(ON=C1C)N)C2=CC=CC=C2

Isomeric SMILES

CCC(CNC(=O)COC(=O)C1=C(ON=C1C)N)C2=CC=CC=C2

InChI

InChI=1S/C17H21N3O4/c1-3-12(13-7-5-4-6-8-13)9-19-14(21)10-23-17(22)15-11(2)20-24-16(15)18/h4-8,12H,3,9-10,18H2,1-2H3,(H,19,21)