2-morpholin-4-ium-4-ylethyl 4-bromanylbenzoate chloride

Systemtic Name: 2-morpholin-4-ium-4-ylethyl 4-bromanylbenzoate chloride Openeye Name: 2-morpholin-4-ium-4-ylethyl 4-bromobenzoate chloride CAS Name: 4-bromobenzoic acid 2-(4-morpholin-4-iumyl)ethyl ester chloride IUPAC Name: 2-morpholin-4-ium-4-ylethyl 4-bromobenzoate chloride Traditional Name: 4-bromobenzoic acid 2-morpholin-4-ium-4-ylethyl ester chloride Formula: C13H17BrClNO3 MolecularWeight: 350.63598

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCOC(=O)C2=CC=C(C=C2)Br.[Cl-]

Isomeric SMILES

C1COCC[NH+]1CCOC(=O)C2=CC=C(C=C2)Br.[Cl-]

InChI

InChI=1S/C13H16BrNO3.ClH/c14-12-3-1-11(2-4-12)13(16)18-10-7-15-5-8-17-9-6-15;/h1-4H,5-10H2;1H