(6-morpholin-4-ium-4-yl-4,4-diphenyl-hexan-3-yl) ethanoate chloride

Systemtic Name: (6-morpholin-4-ium-4-yl-4,4-diphenyl-hexan-3-yl) ethanoate chloride Openeye Name: (1-ethyl-4-morpholin-4-ium-4-yl-2,2-diphenyl-butyl) acetate chloride CAS Name: acetic acid [6-(4-morpholin-4-iumyl)-4,4-diphenylhexan-3-yl] ester chloride IUPAC Name: (6-morpholin-4-ium-4-yl-4,4-diphenylhexan-3-yl) acetate chloride Traditional Name: acetic acid (1-ethyl-4-morpholin-4-ium-4-yl-2,2-diphenyl-butyl) ester chloride Formula: C24H32ClNO3 MolecularWeight: 417.96878

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(CC[NH+]1CCOCC1)(C2=CC=CC=C2)C3=CC=CC=C3)OC(=O)C.[Cl-]

Isomeric SMILES

CCC(C(CC[NH+]1CCOCC1)(C2=CC=CC=C2)C3=CC=CC=C3)OC(=O)C.[Cl-]

InChI

InChI=1S/C24H31NO3.ClH/c1-3-23(28-20(2)26)24(21-10-6-4-7-11-21,22-12-8-5-9-13-22)14-15-25-16-18-27-19-17-25;/h4-13,23H,3,14-19H2,1-2H3;1H