2-(4-butyl-6-chloranyl-2-oxidanylidene-chromen-7-yl)oxy-N-(2-morpholin-4-ium-4-ylethyl)ethanamide

Systemtic Name: 2-(4-butyl-6-chloranyl-2-oxidanylidene-chromen-7-yl)oxy-N-(2-morpholin-4-ium-4-ylethyl)ethanamide Openeye Name: 2-(4-butyl-6-chloro-2-oxo-chromen-7-yl)oxy-N-(2-morpholin-4-ium-4-ylethyl)acetamide CAS Name: 2-[(4-butyl-6-chloro-2-oxo-1-benzopyran-7-yl)oxy]-N-[2-(4-morpholin-4-iumyl)ethyl]acetamide IUPAC Name: 2-(4-butyl-6-chloro-2-oxochromen-7-yl)oxy-N-(2-morpholin-4-ium-4-ylethyl)acetamide Traditional Name: 2-(4-butyl-6-chloro-2-keto-chromen-7-yl)oxy-N-(2-morpholin-4-ium-4-ylethyl)acetamide Formula: C21H28ClN2O5+ MolecularWeight: 423.91042

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=O)OC2=CC(=C(C=C12)Cl)OCC(=O)NCC[NH+]3CCOCC3

Isomeric SMILES

CCCCC1=CC(=O)OC2=CC(=C(C=C12)Cl)OCC(=O)NCC[NH+]3CCOCC3

InChI

InChI=1S/C21H27ClN2O5/c1-2-3-4-15-11-21(26)29-18-13-19(17(22)12-16(15)18)28-14-20(25)23-5-6-24-7-9-27-10-8-24/h11-13H,2-10,14H2,1H3,(H,23,25)/p+1