6-chloranyl-8-[(2,6-dimethylmorpholin-4-ium-4-yl)methyl]-4-methyl-2-oxidanylidene-chromen-7-olate

Systemtic Name: 6-chloranyl-8-[(2,6-dimethylmorpholin-4-ium-4-yl)methyl]-4-methyl-2-oxidanylidene-chromen-7-olate Openeye Name: 6-chloro-8-[(2,6-dimethylmorpholin-4-ium-4-yl)methyl]-4-methyl-2-oxo-chromen-7-olate CAS Name: 6-chloro-8-[(2,6-dimethyl-4-morpholin-4-iumyl)methyl]-4-methyl-2-oxo-1-benzopyran-7-olate IUPAC Name: 6-chloro-8-[(2,6-dimethylmorpholin-4-ium-4-yl)methyl]-4-methyl-2-oxochromen-7-olate Traditional Name: 6-chloro-8-[(2,6-dimethylmorpholin-4-ium-4-yl)methyl]-2-keto-4-methyl-chromen-7-olate Formula: C17H20ClNO4 MolecularWeight: 337.798

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C[NH+](CC(O1)C)CC2=C3C(=CC(=C2[O-])Cl)C(=CC(=O)O3)C

Isomeric SMILES

CC1C[NH+](CC(O1)C)CC2=C3C(=CC(=C2[O-])Cl)C(=CC(=O)O3)C

InChI

InChI=1S/C17H20ClNO4/c1-9-4-15(20)23-17-12(9)5-14(18)16(21)13(17)8-19-6-10(2)22-11(3)7-19/h4-5,10-11,21H,6-8H2,1-3H3