[1,3-bis(oxidanylidene)-2-phenyl-inden-2-yl]methyl 3-morpholin-4-ium-4-ylpropanoate chloride

Systemtic Name: [1,3-bis(oxidanylidene)-2-phenyl-inden-2-yl]methyl 3-morpholin-4-ium-4-ylpropanoate chloride Openeye Name: (1,3-dioxo-2-phenyl-indan-2-yl)methyl 3-morpholin-4-ium-4-ylpropanoate chloride CAS Name: 3-(4-morpholin-4-iumyl)propanoic acid (1,3-dioxo-2-phenyl-2-indenyl)methyl ester chloride IUPAC Name: (1,3-dioxo-2-phenylinden-2-yl)methyl 3-morpholin-4-ium-4-ylpropanoate chloride Traditional Name: 3-morpholin-4-ium-4-ylpropionic acid (1,3-diketo-2-phenyl-indan-2-yl)methyl ester chloride Formula: C23H24ClNO5 MolecularWeight: 429.89336

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCC(=O)OCC2(C(=O)C3=CC=CC=C3C2=O)C4=CC=CC=C4.[Cl-]

Isomeric SMILES

C1COCC[NH+]1CCC(=O)OCC2(C(=O)C3=CC=CC=C3C2=O)C4=CC=CC=C4.[Cl-]

InChI

InChI=1S/C23H23NO5.ClH/c25-20(10-11-24-12-14-28-15-13-24)29-16-23(17-6-2-1-3-7-17)21(26)18-8-4-5-9-19(18)22(23)27;/h1-9H,10-16H2;1H