(phenylmethyl) (4S)-2-azanyl-4-methyl-5-oxidanylidene-4H-imidazole-3-carboxylate

Systemtic Name: (phenylmethyl) (4S)-2-azanyl-4-methyl-5-oxidanylidene-4H-imidazole-3-carboxylate Openeye Name: benzyl (4S)-2-amino-4-methyl-5-oxo-4H-imidazole-3-carboxylate CAS Name: (4S)-2-amino-4-methyl-5-oxo-4H-imidazole-3-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (4S)-2-amino-4-methyl-5-oxo-4H-imidazole-3-carboxylate Traditional Name: (5S)-2-amino-4-keto-5-methyl-2-imidazoline-1-carboxylic acid benzyl ester Formula: C12H13N3O3 MolecularWeight: 247.24992

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N=C(N1C(=O)OCC2=CC=CC=C2)N

Isomeric SMILES

C[C@H]1C(=O)N=C(N1C(=O)OCC2=CC=CC=C2)N

InChI

InChI=1S/C12H13N3O3/c1-8-10(16)14-11(13)15(8)12(17)18-7-9-5-3-2-4-6-9/h2-6,8H,7H2,1H3,(H2,13,14,16)/t8-/m0/s1