(2R)-N-(3-morpholin-4-ium-4-ylpropyl)-2-(3,4,7-trimethyl-2-oxidanylidene-chromen-5-yl)oxy-propanamide

Systemtic Name: (2R)-N-(3-morpholin-4-ium-4-ylpropyl)-2-(3,4,7-trimethyl-2-oxidanylidene-chromen-5-yl)oxy-propanamide Openeye Name: (2R)-N-(3-morpholin-4-ium-4-ylpropyl)-2-(3,4,7-trimethyl-2-oxo-chromen-5-yl)oxy-propanamide CAS Name: (2R)-N-[3-(4-morpholin-4-iumyl)propyl]-2-[(3,4,7-trimethyl-2-oxo-1-benzopyran-5-yl)oxy]propanamide IUPAC Name: (2R)-N-(3-morpholin-4-ium-4-ylpropyl)-2-(3,4,7-trimethyl-2-oxochromen-5-yl)oxypropanamide Traditional Name: (2R)-2-(2-keto-3,4,7-trimethyl-chromen-5-yl)oxy-N-(3-morpholin-4-ium-4-ylpropyl)propionamide Formula: C22H31N2O5+ MolecularWeight: 403.49194

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C(=C(C(=O)O2)C)C)C(=C1)OC(C)C(=O)NCCC[NH+]3CCOCC3

Isomeric SMILES

CC1=CC2=C(C(=C(C(=O)O2)C)C)C(=C1)O[C@H](C)C(=O)NCCC[NH+]3CCOCC3

InChI

InChI=1S/C22H30N2O5/c1-14-12-18(20-15(2)16(3)22(26)29-19(20)13-14)28-17(4)21(25)23-6-5-7-24-8-10-27-11-9-24/h12-13,17H,5-11H2,1-4H3,(H,23,25)/p+1/t17-/m1/s1