(8-iodanyl-4-methyl-2-oxidanylidene-chromen-7-yl) 4-nitrobenzoate

Systemtic Name: (8-iodanyl-4-methyl-2-oxidanylidene-chromen-7-yl) 4-nitrobenzoate Openeye Name: (8-iodo-4-methyl-2-oxo-chromen-7-yl) 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid (8-iodo-4-methyl-2-oxo-1-benzopyran-7-yl) ester IUPAC Name: (8-iodo-4-methyl-2-oxochromen-7-yl) 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid (8-iodo-2-keto-4-methyl-chromen-7-yl) ester Formula: C17H10INO6 MolecularWeight: 451.16887

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C1C=CC(=C2I)OC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=O)OC2=C1C=CC(=C2I)OC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H10INO6/c1-9-8-14(20)25-16-12(9)6-7-13(15(16)18)24-17(21)10-2-4-11(5-3-10)19(22)23/h2-8H,1H3