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

Systemtic Name: 2-ethoxyethyl 4-[(6-bromanyl-2-oxidanylidene-chromen-3-yl)carbonylamino]benzoate Openeye Name: 2-ethoxyethyl 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-ethoxyethyl ester IUPAC Name: 2-ethoxyethyl 4-[(6-bromo-2-oxochromene-3-carbonyl)amino]benzoate Traditional Name: 4-[(6-bromo-2-keto-chromene-3-carbonyl)amino]benzoic acid 2-ethoxyethyl ester Formula: C21H18BrNO6 MolecularWeight: 460.27472

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H18BrNO6/c1-2-27-9-10-28-20(25)13-3-6-16(7-4-13)23-19(24)17-12-14-11-15(22)5-8-18(14)29-21(17)26/h3-8,11-12H,2,9-10H2,1H3,(H,23,24)