6-chloranyl-3-ethyl-8-[(2-ethylpiperidin-1-ium-1-yl)methyl]-4-methyl-2-oxidanylidene-chromen-7-olate

Systemtic Name: 6-chloranyl-3-ethyl-8-[(2-ethylpiperidin-1-ium-1-yl)methyl]-4-methyl-2-oxidanylidene-chromen-7-olate Openeye Name: 6-chloro-3-ethyl-8-[(2-ethylpiperidin-1-ium-1-yl)methyl]-4-methyl-2-oxo-chromen-7-olate CAS Name: 6-chloro-3-ethyl-8-[(2-ethyl-1-piperidin-1-iumyl)methyl]-4-methyl-2-oxo-1-benzopyran-7-olate IUPAC Name: 6-chloro-3-ethyl-8-[(2-ethylpiperidin-1-ium-1-yl)methyl]-4-methyl-2-oxochromen-7-olate Traditional Name: 6-chloro-3-ethyl-8-[(2-ethylpiperidin-1-ium-1-yl)methyl]-2-keto-4-methyl-chromen-7-olate Formula: C20H26ClNO3 MolecularWeight: 363.87834

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCC[NH+]1CC2=C3C(=CC(=C2[O-])Cl)C(=C(C(=O)O3)CC)C

Isomeric SMILES

CCC1CCCC[NH+]1CC2=C3C(=CC(=C2[O-])Cl)C(=C(C(=O)O3)CC)C

InChI

InChI=1S/C20H26ClNO3/c1-4-13-8-6-7-9-22(13)11-16-18(23)17(21)10-15-12(3)14(5-2)20(24)25-19(15)16/h10,13,23H,4-9,11H2,1-3H3