4-(3,3-diphenyl-4-propoxy-hexyl)morpholin-4-ium chloride

Systemtic Name: 4-(3,3-diphenyl-4-propoxy-hexyl)morpholin-4-ium chloride Openeye Name: 4-(3,3-diphenyl-4-propoxy-hexyl)morpholin-4-ium chloride CAS Name: 4-(3,3-diphenyl-4-propoxyhexyl)morpholin-4-ium chloride IUPAC Name: 4-(3,3-diphenyl-4-propoxyhexyl)morpholin-4-ium chloride Traditional Name: 4-(3,3-diphenyl-4-propoxy-hexyl)morpholin-4-ium chloride Formula: C25H36ClNO2 MolecularWeight: 418.01184

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H35NO2.ClH/c1-3-19-28-24(4-2)25(22-11-7-5-8-12-22,23-13-9-6-10-14-23)15-16-26-17-20-27-21-18-26;/h5-14,24H,3-4,15-21H2,1-2H3;1H