(7-bromanyl-2-oxidanylidene-chromen-4-yl)methyl 2-[(4-cyanophenyl)sulfonylamino]ethanoate

Systemtic Name: (7-bromanyl-2-oxidanylidene-chromen-4-yl)methyl 2-[(4-cyanophenyl)sulfonylamino]ethanoate Openeye Name: (7-bromo-2-oxo-chromen-4-yl)methyl 2-[(4-cyanophenyl)sulfonylamino]acetate CAS Name: 2-[(4-cyanophenyl)sulfonylamino]acetic acid (7-bromo-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-bromo-2-oxochromen-4-yl)methyl 2-[(4-cyanophenyl)sulfonylamino]acetate Traditional Name: 2-[(4-cyanophenyl)sulfonylamino]acetic acid (7-bromo-2-keto-chromen-4-yl)methyl ester Formula: C19H13BrN2O6S MolecularWeight: 477.28532

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)S(=O)(=O)NCC(=O)OCC2=CC(=O)OC3=C2C=CC(=C3)Br

Isomeric SMILES

C1=CC(=CC=C1C#N)S(=O)(=O)NCC(=O)OCC2=CC(=O)OC3=C2C=CC(=C3)Br

InChI

InChI=1S/C19H13BrN2O6S/c20-14-3-6-16-13(7-18(23)28-17(16)8-14)11-27-19(24)10-22-29(25,26)15-4-1-12(9-21)2-5-15/h1-8,22H,10-11H2