propyl 4-(2-methyl-7-methylsulfonyloxy-4-oxidanylidene-chromen-3-yl)oxybenzoate

Systemtic Name: propyl 4-(2-methyl-7-methylsulfonyloxy-4-oxidanylidene-chromen-3-yl)oxybenzoate Openeye Name: propyl 4-(2-methyl-7-methylsulfonyloxy-4-oxo-chromen-3-yl)oxybenzoate CAS Name: 4-[(2-methyl-7-methylsulfonyloxy-4-oxo-1-benzopyran-3-yl)oxy]benzoic acid propyl ester IUPAC Name: propyl 4-(2-methyl-7-methylsulfonyloxy-4-oxochromen-3-yl)oxybenzoate Traditional Name: 4-(4-keto-2-methyl-7-methylsulfonyloxy-chromen-3-yl)oxybenzoic acid propyl ester Formula: C21H20O8S MolecularWeight: 432.4437

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC=C(C=C1)OC2=C(OC3=C(C2=O)C=CC(=C3)OS(=O)(=O)C)C

Isomeric SMILES

CCCOC(=O)C1=CC=C(C=C1)OC2=C(OC3=C(C2=O)C=CC(=C3)OS(=O)(=O)C)C

InChI

InChI=1S/C21H20O8S/c1-4-11-26-21(23)14-5-7-15(8-6-14)28-20-13(2)27-18-12-16(29-30(3,24)25)9-10-17(18)19(20)22/h5-10,12H,4,11H2,1-3H3