N-[(3-methoxy-4-oxidanyl-phenyl)methyl]-1-methylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[(3-methoxy-4-oxidanyl-phenyl)methyl]-1-methylsulfonyl-piperidine-4-carboxamide Openeye Name: N-[(4-hydroxy-3-methoxy-phenyl)methyl]-1-methylsulfonyl-piperidine-4-carboxamide CAS Name: N-[(4-hydroxy-3-methoxyphenyl)methyl]-1-methylsulfonyl-4-piperidinecarboxamide IUPAC Name: N-[(4-hydroxy-3-methoxyphenyl)methyl]-1-methylsulfonylpiperidine-4-carboxamide Traditional Name: 1-mesyl-N-vanillyl-isonipecotamide Formula: C15H22N2O5S MolecularWeight: 342.41058

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CNC(=O)C2CCN(CC2)S(=O)(=O)C)O

Isomeric SMILES

COC1=C(C=CC(=C1)CNC(=O)C2CCN(CC2)S(=O)(=O)C)O

InChI

InChI=1S/C15H22N2O5S/c1-22-14-9-11(3-4-13(14)18)10-16-15(19)12-5-7-17(8-6-12)23(2,20)21/h3-4,9,12,18H,5-8,10H2,1-2H3,(H,16,19)