(3,4-dimethyl-2-phenyl-morpholin-4-ium-4-yl)methyl benzoate chloride

Systemtic Name: (3,4-dimethyl-2-phenyl-morpholin-4-ium-4-yl)methyl benzoate chloride Openeye Name: (3,4-dimethyl-2-phenyl-morpholin-4-ium-4-yl)methyl benzoate chloride CAS Name: benzoic acid (3,4-dimethyl-2-phenyl-4-morpholin-4-iumyl)methyl ester chloride IUPAC Name: (3,4-dimethyl-2-phenylmorpholin-4-ium-4-yl)methyl benzoate chloride Traditional Name: benzoic acid (3,4-dimethyl-2-phenyl-morpholin-4-ium-4-yl)methyl ester chloride Formula: C20H24ClNO3 MolecularWeight: 361.86246

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(OCC[N+]1(C)COC(=O)C2=CC=CC=C2)C3=CC=CC=C3.[Cl-]

Isomeric SMILES

CC1C(OCC[N+]1(C)COC(=O)C2=CC=CC=C2)C3=CC=CC=C3.[Cl-]

InChI

InChI=1S/C20H24NO3.ClH/c1-16-19(17-9-5-3-6-10-17)23-14-13-21(16,2)15-24-20(22)18-11-7-4-8-12-18;/h3-12,16,19H,13-15H2,1-2H3;1H/q+1;/p-1