4-(2-methylprop-2-enyl)-3-oxidanylidene-1,4-benzoxazine-7-carboxylate

Systemtic Name: 4-(2-methylprop-2-enyl)-3-oxidanylidene-1,4-benzoxazine-7-carboxylate Openeye Name: 4-(2-methylallyl)-3-oxo-1,4-benzoxazine-7-carboxylate CAS Name: 4-(2-methylprop-2-enyl)-3-oxo-1,4-benzoxazine-7-carboxylate IUPAC Name: 4-(2-methylprop-2-enyl)-3-oxo-1,4-benzoxazine-7-carboxylate Traditional Name: 3-keto-4-(2-methylallyl)-1,4-benzoxazine-7-carboxylate Formula: C13H12NO4- MolecularWeight: 246.23868

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)CN1C(=O)COC2=C1C=CC(=C2)C(=O)[O-]

Isomeric SMILES

CC(=C)CN1C(=O)COC2=C1C=CC(=C2)C(=O)[O-]

InChI

InChI=1S/C13H13NO4/c1-8(2)6-14-10-4-3-9(13(16)17)5-11(10)18-7-12(14)15/h3-5H,1,6-7H2,2H3,(H,16,17)/p-1