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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H18BrNO5/c1-2-3-10-27-20(25)13-4-7-16(8-5-13)23-19(24)17-12-14-11-15(22)6-9-18(14)28-21(17)26/h4-9,11-12H,2-3,10H2,1H3,(H,23,24)