4-butyl-3-oxidanylidene-1,4-benzoxazine-7-carboxylate

Systemtic Name: 4-butyl-3-oxidanylidene-1,4-benzoxazine-7-carboxylate Openeye Name: 4-butyl-3-oxo-1,4-benzoxazine-7-carboxylate CAS Name: 4-butyl-3-oxo-1,4-benzoxazine-7-carboxylate IUPAC Name: 4-butyl-3-oxo-1,4-benzoxazine-7-carboxylate Traditional Name: 4-butyl-3-keto-1,4-benzoxazine-7-carboxylate Formula: C13H14NO4- MolecularWeight: 248.25456

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)COC2=C1C=CC(=C2)C(=O)[O-]

Isomeric SMILES

CCCCN1C(=O)COC2=C1C=CC(=C2)C(=O)[O-]

InChI

InChI=1S/C13H15NO4/c1-2-3-6-14-10-5-4-9(13(16)17)7-11(10)18-8-12(14)15/h4-5,7H,2-3,6,8H2,1H3,(H,16,17)/p-1