(2R)-6-azanyl-4-[(2S)-2,3-bis(oxidanyl)propyl]-2-methyl-1,4-benzoxazin-3-one

Systemtic Name: (2R)-6-azanyl-4-[(2S)-2,3-bis(oxidanyl)propyl]-2-methyl-1,4-benzoxazin-3-one Openeye Name: (2R)-6-amino-4-[(2S)-2,3-dihydroxypropyl]-2-methyl-1,4-benzoxazin-3-one CAS Name: (2R)-6-amino-4-[(2S)-2,3-dihydroxypropyl]-2-methyl-1,4-benzoxazin-3-one IUPAC Name: (2R)-6-amino-4-[(2S)-2,3-dihydroxypropyl]-2-methyl-1,4-benzoxazin-3-one Traditional Name: (2R)-6-amino-4-[(2S)-2,3-dihydroxypropyl]-2-methyl-1,4-benzoxazin-3-one Formula: C12H16N2O4 MolecularWeight: 252.26644

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(C2=C(O1)C=CC(=C2)N)CC(CO)O

Isomeric SMILES

C[C@@H]1C(=O)N(C2=C(O1)C=CC(=C2)N)C[C@@H](CO)O

InChI

InChI=1S/C12H16N2O4/c1-7-12(17)14(5-9(16)6-15)10-4-8(13)2-3-11(10)18-7/h2-4,7,9,15-16H,5-6,13H2,1H3/t7-,9+/m1/s1