hexyl 4-[(6-bromanyl-2-oxidanylidene-chromen-3-yl)carbonylamino]benzoate

Systemtic Name: hexyl 4-[(6-bromanyl-2-oxidanylidene-chromen-3-yl)carbonylamino]benzoate Openeye Name: hexyl 4-[(6-bromo-2-oxo-chromene-3-carbonyl)amino]benzoate CAS Name: 4-[[(6-bromo-2-oxo-1-benzopyran-3-yl)-oxomethyl]amino]benzoic acid hexyl ester IUPAC Name: hexyl 4-[(6-bromo-2-oxochromene-3-carbonyl)amino]benzoate Traditional Name: 4-[(6-bromo-2-keto-chromene-3-carbonyl)amino]benzoic acid hexyl ester Formula: C23H22BrNO5 MolecularWeight: 472.32848

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC3=C(C=CC(=C3)Br)OC2=O

Isomeric SMILES

CCCCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC3=C(C=CC(=C3)Br)OC2=O

InChI

InChI=1S/C23H22BrNO5/c1-2-3-4-5-12-29-22(27)15-6-9-18(10-7-15)25-21(26)19-14-16-13-17(24)8-11-20(16)30-23(19)28/h6-11,13-14H,2-5,12H2,1H3,(H,25,26)