O-(2-morpholin-4-ium-4-ylethyl) 4-ethoxybenzenecarbothioate chloride

Systemtic Name: O-(2-morpholin-4-ium-4-ylethyl) 4-ethoxybenzenecarbothioate chloride Openeye Name: O-(2-morpholin-4-ium-4-ylethyl) 4-ethoxybenzenecarbothioate chloride CAS Name: 4-ethoxybenzenecarbothioic acid O-[2-(4-morpholin-4-iumyl)ethyl] ester chloride IUPAC Name: O-(2-morpholin-4-ium-4-ylethyl) 4-ethoxybenzenecarbothioate chloride Traditional Name: 4-ethoxythiobenzoic acid O-(2-morpholin-4-ium-4-ylethyl) ester chloride Formula: C15H22ClNO3S MolecularWeight: 331.85808

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=S)OCC[NH+]2CCOCC2.[Cl-]

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=S)OCC[NH+]2CCOCC2.[Cl-]

InChI

InChI=1S/C15H21NO3S.ClH/c1-2-18-14-5-3-13(4-6-14)15(20)19-12-9-16-7-10-17-11-8-16;/h3-6H,2,7-12H2,1H3;1H