(3aS,6aR)-4-azanyl-3-methyl-3a-phenethyl-6aH-[1,3]oxazolo[4,5-d][1,2]oxazol-5-one

Systemtic Name: (3aS,6aR)-4-azanyl-3-methyl-3a-phenethyl-6aH-[1,3]oxazolo[4,5-d][1,2]oxazol-5-one Openeye Name: (3aS,6aR)-4-amino-3-methyl-3a-phenethyl-6aH-oxazolo[4,5-d]isoxazol-5-one CAS Name: (3aS,6aR)-4-amino-3-methyl-3a-phenethyl-6aH-oxazolo[4,5-d]isoxazol-5-one IUPAC Name: (3aS,6aR)-4-amino-3-methyl-3a-phenethyl-6aH-[1,3]oxazolo[4,5-d][1,2]oxazol-5-one Traditional Name: (3aS,6aR)-4-amino-3-methyl-3a-phenethyl-6aH-oxazol[4,5-d]isoxazol-5-one Formula: C13H15N3O3 MolecularWeight: 261.2765

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC2C1(N(C(=O)O2)N)CCC3=CC=CC=C3

Isomeric SMILES

CC1=NO[C@@H]2[C@]1(N(C(=O)O2)N)CCC3=CC=CC=C3

InChI

InChI=1S/C13H15N3O3/c1-9-13(8-7-10-5-3-2-4-6-10)11(19-15-9)18-12(17)16(13)14/h2-6,11H,7-8,14H2,1H3/t11-,13+/m1/s1