2-(6-chloranyl-3,4-dimethyl-2-oxidanylidene-chromen-7-yl)oxy-N-(3-morpholin-4-ium-4-ylpropyl)ethanamide

Systemtic Name: 2-(6-chloranyl-3,4-dimethyl-2-oxidanylidene-chromen-7-yl)oxy-N-(3-morpholin-4-ium-4-ylpropyl)ethanamide Openeye Name: 2-(6-chloro-3,4-dimethyl-2-oxo-chromen-7-yl)oxy-N-(3-morpholin-4-ium-4-ylpropyl)acetamide CAS Name: 2-[(6-chloro-3,4-dimethyl-2-oxo-1-benzopyran-7-yl)oxy]-N-[3-(4-morpholin-4-iumyl)propyl]acetamide IUPAC Name: 2-(6-chloro-3,4-dimethyl-2-oxochromen-7-yl)oxy-N-(3-morpholin-4-ium-4-ylpropyl)acetamide Traditional Name: 2-(6-chloro-2-keto-3,4-dimethyl-chromen-7-yl)oxy-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)OCC(=O)NCCC[NH+]3CCOCC3)C

Isomeric SMILES

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

InChI

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