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

Systemtic Name: 2-(6-chloranyl-7-methoxy-4-methyl-2-oxidanylidene-chromen-3-yl)-N-(3-morpholin-4-ium-4-ylpropyl)ethanamide Openeye Name: 2-(6-chloro-7-methoxy-4-methyl-2-oxo-chromen-3-yl)-N-(3-morpholin-4-ium-4-ylpropyl)acetamide CAS Name: 2-(6-chloro-7-methoxy-4-methyl-2-oxo-1-benzopyran-3-yl)-N-[3-(4-morpholin-4-iumyl)propyl]acetamide IUPAC Name: 2-(6-chloro-7-methoxy-4-methyl-2-oxochromen-3-yl)-N-(3-morpholin-4-ium-4-ylpropyl)acetamide Traditional Name: 2-(6-chloro-2-keto-7-methoxy-4-methyl-chromen-3-yl)-N-(3-morpholin-4-ium-4-ylpropyl)acetamide Formula: C20H26ClN2O5+ MolecularWeight: 409.88384

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H25ClN2O5/c1-13-14-10-16(21)18(26-2)12-17(14)28-20(25)15(13)11-19(24)22-4-3-5-23-6-8-27-9-7-23/h10,12H,3-9,11H2,1-2H3,(H,22,24)/p+1