(2R)-4-[(2S)-2,3-bis(oxidanyl)propyl]-2-ethyl-3-oxidanylidene-1,4-benzoxazine-6-carbaldehyde

Systemtic Name: (2R)-4-[(2S)-2,3-bis(oxidanyl)propyl]-2-ethyl-3-oxidanylidene-1,4-benzoxazine-6-carbaldehyde Openeye Name: (2R)-4-[(2S)-2,3-dihydroxypropyl]-2-ethyl-3-oxo-1,4-benzoxazine-6-carbaldehyde CAS Name: (2R)-4-[(2S)-2,3-dihydroxypropyl]-2-ethyl-3-oxo-1,4-benzoxazine-6-carboxaldehyde IUPAC Name: (2R)-4-[(2S)-2,3-dihydroxypropyl]-2-ethyl-3-oxo-1,4-benzoxazine-6-carbaldehyde Traditional Name: (2R)-4-[(2S)-2,3-dihydroxypropyl]-2-ethyl-3-keto-1,4-benzoxazine-6-carbaldehyde Formula: C14H17NO5 MolecularWeight: 279.28848

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17NO5/c1-2-12-14(19)15(6-10(18)8-17)11-5-9(7-16)3-4-13(11)20-12/h3-5,7,10,12,17-18H,2,6,8H2,1H3/t10-,12+/m0/s1