butyl 4-[(4-oxidanylidene-3,1-benzoxazin-1-ium-2-yl)amino]benzoate

Systemtic Name: butyl 4-[(4-oxidanylidene-3,1-benzoxazin-1-ium-2-yl)amino]benzoate Openeye Name: butyl 4-[(4-oxo-3,1-benzoxazin-1-ium-2-yl)amino]benzoate CAS Name: 4-[(4-oxo-3,1-benzoxazin-1-ium-2-yl)amino]benzoic acid butyl ester IUPAC Name: butyl 4-[(4-oxo-3,1-benzoxazin-1-ium-2-yl)amino]benzoate Traditional Name: 4-[(4-keto-3,1-benzoxazin-1-ium-2-yl)amino]benzoic acid butyl ester Formula: C19H19N2O4+ MolecularWeight: 339.36516

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC2=[NH+]C3=CC=CC=C3C(=O)O2

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC2=[NH+]C3=CC=CC=C3C(=O)O2

InChI

InChI=1S/C19H18N2O4/c1-2-3-12-24-17(22)13-8-10-14(11-9-13)20-19-21-16-7-5-4-6-15(16)18(23)25-19/h4-11H,2-3,12H2,1H3,(H,20,21)/p+1