(2-oxidanylidene-4-propyl-chromen-7-yl) 5-chloranyl-1-methyl-imidazole-4-sulfonate

Systemtic Name: (2-oxidanylidene-4-propyl-chromen-7-yl) 5-chloranyl-1-methyl-imidazole-4-sulfonate Openeye Name: (2-oxo-4-propyl-chromen-7-yl) 5-chloro-1-methyl-imidazole-4-sulfonate CAS Name: 5-chloro-1-methyl-4-imidazolesulfonic acid (2-oxo-4-propyl-1-benzopyran-7-yl) ester IUPAC Name: (2-oxo-4-propylchromen-7-yl) 5-chloro-1-methylimidazole-4-sulfonate Traditional Name: 5-chloro-1-methyl-imidazole-4-sulfonic acid (2-keto-4-propyl-chromen-7-yl) ester Formula: C16H15ClN2O5S MolecularWeight: 382.8187

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)OC2=C1C=CC(=C2)OS(=O)(=O)C3=C(N(C=N3)C)Cl

Isomeric SMILES

CCCC1=CC(=O)OC2=C1C=CC(=C2)OS(=O)(=O)C3=C(N(C=N3)C)Cl

InChI

InChI=1S/C16H15ClN2O5S/c1-3-4-10-7-14(20)23-13-8-11(5-6-12(10)13)24-25(21,22)16-15(17)19(2)9-18-16/h5-9H,3-4H2,1-2H3