methyl (4aR,5S,8aR)-2-methylidene-5-oxidanyl-3-oxidanylidene-4a,5,8,8a-tetrahydro-4H-1,4-benzoxazine-7-carboxylate

Systemtic Name: methyl (4aR,5S,8aR)-2-methylidene-5-oxidanyl-3-oxidanylidene-4a,5,8,8a-tetrahydro-4H-1,4-benzoxazine-7-carboxylate Openeye Name: methyl (4aR,5S,8aR)-5-hydroxy-2-methylene-3-oxo-4a,5,8,8a-tetrahydro-4H-1,4-benzoxazine-7-carboxylate CAS Name: (4aR,5S,8aR)-5-hydroxy-2-methylene-3-oxo-4a,5,8,8a-tetrahydro-4H-1,4-benzoxazine-7-carboxylic acid methyl ester IUPAC Name: methyl (4aR,5S,8aR)-5-hydroxy-2-methylidene-3-oxo-4a,5,8,8a-tetrahydro-4H-1,4-benzoxazine-7-carboxylate Traditional Name: (4aR,5S,8aR)-5-hydroxy-3-keto-2-methylene-4a,5,8,8a-tetrahydro-4H-1,4-benzoxazine-7-carboxylic acid methyl ester Formula: C11H13NO5 MolecularWeight: 239.22462

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(C2C(C1)OC(=C)C(=O)N2)O

Isomeric SMILES

COC(=O)C1=C[C@@H]([C@@H]2[C@@H](C1)OC(=C)C(=O)N2)O

InChI

InChI=1S/C11H13NO5/c1-5-10(14)12-9-7(13)3-6(11(15)16-2)4-8(9)17-5/h3,7-9,13H,1,4H2,2H3,(H,12,14)/t7-,8+,9+/m0/s1