(4-ethyl-7-oxidanyl-2-oxidanylidene-chromen-8-yl)methyl-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)azanium

Systemtic Name: (4-ethyl-7-oxidanyl-2-oxidanylidene-chromen-8-yl)methyl-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)azanium Openeye Name: (4-ethyl-7-hydroxy-2-oxo-chromen-8-yl)methyl-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)ammonium CAS Name: (4-ethyl-7-hydroxy-2-oxo-1-benzopyran-8-yl)methyl-(2,2,6,6-tetramethyl-4-piperidin-1-iumyl)ammonium IUPAC Name: (4-ethyl-7-hydroxy-2-oxochromen-8-yl)methyl-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)azanium Traditional Name: (4-ethyl-7-hydroxy-2-keto-chromen-8-yl)methyl-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)ammonium Formula: C21H32N2O3+2 MolecularWeight: 360.49038

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=O)OC2=C1C=CC(=C2C[NH2+]C3CC([NH2+]C(C3)(C)C)(C)C)O

Isomeric SMILES

CCC1=CC(=O)OC2=C1C=CC(=C2C[NH2+]C3CC([NH2+]C(C3)(C)C)(C)C)O

InChI

InChI=1S/C21H30N2O3/c1-6-13-9-18(25)26-19-15(13)7-8-17(24)16(19)12-22-14-10-20(2,3)23-21(4,5)11-14/h7-9,14,22-24H,6,10-12H2,1-5H3/p+2