N-[2-(isoquinolin-3-ylmethylsulfonyl)-1-(4-methoxyphenyl)ethyl]-N-oxidanyl-methanamide

Systemtic Name: N-[2-(isoquinolin-3-ylmethylsulfonyl)-1-(4-methoxyphenyl)ethyl]-N-oxidanyl-methanamide Openeye Name: N-hydroxy-N-[2-(3-isoquinolylmethylsulfonyl)-1-(4-methoxyphenyl)ethyl]formamide CAS Name: N-hydroxy-N-[2-(3-isoquinolinylmethylsulfonyl)-1-(4-methoxyphenyl)ethyl]formamide IUPAC Name: N-hydroxy-N-[2-(isoquinolin-3-ylmethylsulfonyl)-1-(4-methoxyphenyl)ethyl]formamide Traditional Name: N-hydroxy-N-[2-(3-isoquinolylmethylsulfonyl)-1-(4-methoxyphenyl)ethyl]formamide Formula: C20H20N2O5S MolecularWeight: 400.4482

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(CS(=O)(=O)CC2=CC3=CC=CC=C3C=N2)N(C=O)O

Isomeric SMILES

COC1=CC=C(C=C1)C(CS(=O)(=O)CC2=CC3=CC=CC=C3C=N2)N(C=O)O

InChI

InChI=1S/C20H20N2O5S/c1-27-19-8-6-15(7-9-19)20(22(24)14-23)13-28(25,26)12-18-10-16-4-2-3-5-17(16)11-21-18/h2-11,14,20,24H,12-13H2,1H3