2-(6-chloranyl-4-methyl-7-oxidanyl-2-oxidanylidene-chromen-3-yl)-N-(3-morpholin-4-ium-4-ylpropyl)ethanamide

Systemtic Name: 2-(6-chloranyl-4-methyl-7-oxidanyl-2-oxidanylidene-chromen-3-yl)-N-(3-morpholin-4-ium-4-ylpropyl)ethanamide Openeye Name: 2-(6-chloro-7-hydroxy-4-methyl-2-oxo-chromen-3-yl)-N-(3-morpholin-4-ium-4-ylpropyl)acetamide CAS Name: 2-(6-chloro-7-hydroxy-4-methyl-2-oxo-1-benzopyran-3-yl)-N-[3-(4-morpholin-4-iumyl)propyl]acetamide IUPAC Name: 2-(6-chloro-7-hydroxy-4-methyl-2-oxochromen-3-yl)-N-(3-morpholin-4-ium-4-ylpropyl)acetamide Traditional Name: 2-(6-chloro-7-hydroxy-2-keto-4-methyl-chromen-3-yl)-N-(3-morpholin-4-ium-4-ylpropyl)acetamide Formula: C19H24ClN2O5+ MolecularWeight: 395.85726

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=CC(=C(C=C12)Cl)O)CC(=O)NCCC[NH+]3CCOCC3

Isomeric SMILES

CC1=C(C(=O)OC2=CC(=C(C=C12)Cl)O)CC(=O)NCCC[NH+]3CCOCC3

InChI

InChI=1S/C19H23ClN2O5/c1-12-13-9-15(20)16(23)11-17(13)27-19(25)14(12)10-18(24)21-3-2-4-22-5-7-26-8-6-22/h9,11,23H,2-8,10H2,1H3,(H,21,24)/p+1