2-[3-[2-(4-methoxyphenyl)ethanoylamino]phenyl]sulfonyl-N-oxidanyl-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: 2-[3-[2-(4-methoxyphenyl)ethanoylamino]phenyl]sulfonyl-N-oxidanyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: N-[3-[[3-(hydroxycarbamoyl)-3,4-dihydro-1H-isoquinolin-2-yl]sulfonyl]phenyl]-2-(4-methoxyphenyl)acetamide CAS Name: N-hydroxy-2-[3-[[2-(4-methoxyphenyl)-1-oxoethyl]amino]phenyl]sulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: N-hydroxy-2-[3-[[2-(4-methoxyphenyl)acetyl]amino]phenyl]sulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: N-[3-[[3-(hydroxycarbamoyl)-3,4-dihydro-1H-isoquinolin-2-yl]sulfonyl]phenyl]-2-(4-methoxyphenyl)acetamide Formula: C25H25N3O6S MolecularWeight: 495.5475

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CC4=CC=CC=C4CC3C(=O)NO

Isomeric SMILES

COC1=CC=C(C=C1)CC(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CC4=CC=CC=C4CC3C(=O)NO

InChI

InChI=1S/C25H25N3O6S/c1-34-21-11-9-17(10-12-21)13-24(29)26-20-7-4-8-22(15-20)35(32,33)28-16-19-6-3-2-5-18(19)14-23(28)25(30)27-31/h2-12,15,23,31H,13-14,16H2,1H3,(H,26,29)(H,27,30)