6-morpholin-4-ium-4-yl-3-phenyl-hex-4-ynoic acid chloride

Systemtic Name: 6-morpholin-4-ium-4-yl-3-phenyl-hex-4-ynoic acid chloride Openeye Name: 6-morpholin-4-ium-4-yl-3-phenyl-hex-4-ynoic acid chloride CAS Name: 6-(4-morpholin-4-iumyl)-3-phenyl-4-hexynoic acid chloride IUPAC Name: 6-morpholin-4-ium-4-yl-3-phenylhex-4-ynoic acid chloride Traditional Name: 6-morpholin-4-ium-4-yl-3-phenyl-hex-4-ynoic acid chloride Formula: C16H20ClNO3 MolecularWeight: 309.7879

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CC#CC(CC(=O)O)C2=CC=CC=C2.[Cl-]

Isomeric SMILES

C1COCC[NH+]1CC#CC(CC(=O)O)C2=CC=CC=C2.[Cl-]

InChI

InChI=1S/C16H19NO3.ClH/c18-16(19)13-15(14-5-2-1-3-6-14)7-4-8-17-9-11-20-12-10-17;/h1-3,5-6,15H,8-13H2,(H,18,19);1H