7-butanoyl-2,2-dimethyl-4H-1,2-benzoxazin-2-ium-3-one

Systemtic Name: 7-butanoyl-2,2-dimethyl-4H-1,2-benzoxazin-2-ium-3-one Openeye Name: 7-butanoyl-2,2-dimethyl-4H-1,2-benzoxazin-2-ium-3-one CAS Name: 2,2-dimethyl-7-(1-oxobutyl)-4H-1,2-benzoxazin-2-ium-3-one IUPAC Name: 7-butanoyl-2,2-dimethyl-4H-1,2-benzoxazin-2-ium-3-one Traditional Name: 7-butyryl-2,2-dimethyl-4H-1,2-benzoxazin-2-ium-3-one Formula: C14H18NO3+ MolecularWeight: 248.29762

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1=CC2=C(CC(=O)[N+](O2)(C)C)C=C1

Isomeric SMILES

CCCC(=O)C1=CC2=C(CC(=O)[N+](O2)(C)C)C=C1

InChI

InChI=1S/C14H18NO3/c1-4-5-12(16)10-6-7-11-9-14(17)15(2,3)18-13(11)8-10/h6-8H,4-5,9H2,1-3H3/q+1