ethyl 4-morpholin-4-ium-4-yl-2,2-diphenyl-butanoate chloride

Systemtic Name: ethyl 4-morpholin-4-ium-4-yl-2,2-diphenyl-butanoate chloride Openeye Name: ethyl 4-morpholin-4-ium-4-yl-2,2-diphenyl-butanoate chloride CAS Name: 4-(4-morpholin-4-iumyl)-2,2-diphenylbutanoic acid ethyl ester chloride IUPAC Name: ethyl 4-morpholin-4-ium-4-yl-2,2-diphenylbutanoate chloride Traditional Name: 4-morpholin-4-ium-4-yl-2,2-diphenyl-butyric acid ethyl ester chloride Formula: C22H28ClNO3 MolecularWeight: 389.91562

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27NO3.ClH/c1-2-26-21(24)22(19-9-5-3-6-10-19,20-11-7-4-8-12-20)13-14-23-15-17-25-18-16-23;/h3-12H,2,13-18H2,1H3;1H