(2R)-7-azanyl-4-[(2S)-2,3-bis(oxidanyl)propyl]-2-ethyl-1,4-benzoxazin-3-one

Systemtic Name: (2R)-7-azanyl-4-[(2S)-2,3-bis(oxidanyl)propyl]-2-ethyl-1,4-benzoxazin-3-one Openeye Name: (2R)-7-amino-4-[(2S)-2,3-dihydroxypropyl]-2-ethyl-1,4-benzoxazin-3-one CAS Name: (2R)-7-amino-4-[(2S)-2,3-dihydroxypropyl]-2-ethyl-1,4-benzoxazin-3-one IUPAC Name: (2R)-7-amino-4-[(2S)-2,3-dihydroxypropyl]-2-ethyl-1,4-benzoxazin-3-one Traditional Name: (2R)-7-amino-4-[(2S)-2,3-dihydroxypropyl]-2-ethyl-1,4-benzoxazin-3-one Formula: C13H18N2O4 MolecularWeight: 266.29302

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=O)N(C2=C(O1)C=C(C=C2)N)CC(CO)O

Isomeric SMILES

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

InChI

InChI=1S/C13H18N2O4/c1-2-11-13(18)15(6-9(17)7-16)10-4-3-8(14)5-12(10)19-11/h3-5,9,11,16-17H,2,6-7,14H2,1H3/t9-,11+/m0/s1