methyl 4-(3-morpholin-4-ylpropylsulfanyl)benzoate chloride

Systemtic Name: methyl 4-(3-morpholin-4-ylpropylsulfanyl)benzoate chloride Openeye Name: methyl 4-(3-morpholinopropylsulfanyl)benzoate chloride CAS Name: 4-[3-(4-morpholinyl)propylthio]benzoic acid methyl ester chloride IUPAC Name: methyl 4-(3-morpholin-4-ylpropylsulfanyl)benzoate chloride Traditional Name: 4-(3-morpholinopropylthio)benzoic acid methyl ester chloride Formula: C15H21ClNO3S- MolecularWeight: 330.85014

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)SCCCN2CCOCC2.[Cl-]

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)SCCCN2CCOCC2.[Cl-]

InChI

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