methyl 4-oxidanyl-3-(piperidin-1-ylmethylsulfanyl)benzoate

Systemtic Name: methyl 4-oxidanyl-3-(piperidin-1-ylmethylsulfanyl)benzoate Openeye Name: methyl 4-hydroxy-3-(1-piperidylmethylsulfanyl)benzoate CAS Name: 4-hydroxy-3-(1-piperidinylmethylthio)benzoic acid methyl ester IUPAC Name: methyl 4-hydroxy-3-(piperidin-1-ylmethylsulfanyl)benzoate Traditional Name: 4-hydroxy-3-(piperidinomethylthio)benzoic acid methyl ester Formula: C14H19NO3S MolecularWeight: 281.37056

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)O)SCN2CCCCC2

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)O)SCN2CCCCC2

InChI

InChI=1S/C14H19NO3S/c1-18-14(17)11-5-6-12(16)13(9-11)19-10-15-7-3-2-4-8-15/h5-6,9,16H,2-4,7-8,10H2,1H3