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

Systemtic Name: 2-methylpropyl 4-[(6-bromanyl-2-oxidanylidene-chromen-3-yl)carbonylamino]benzoate Openeye Name: isobutyl 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 2-methylpropyl ester IUPAC Name: 2-methylpropyl 4-[(6-bromo-2-oxochromene-3-carbonyl)amino]benzoate Traditional Name: 4-[(6-bromo-2-keto-chromene-3-carbonyl)amino]benzoic acid isobutyl ester Formula: C21H18BrNO5 MolecularWeight: 444.27532

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H18BrNO5/c1-12(2)11-27-20(25)13-3-6-16(7-4-13)23-19(24)17-10-14-9-15(22)5-8-18(14)28-21(17)26/h3-10,12H,11H2,1-2H3,(H,23,24)