4-[4-[5-(3,4-dihydro-1H-isoquinolin-2-yl)-5-oxidanylidene-pentyl]piperidin-1-yl]sulfonyl-N-oxidanyl-oxane-4-carboxamide

Systemtic Name: 4-[4-[5-(3,4-dihydro-1H-isoquinolin-2-yl)-5-oxidanylidene-pentyl]piperidin-1-yl]sulfonyl-N-oxidanyl-oxane-4-carboxamide Openeye Name: 4-[[4-[5-(3,4-dihydro-1H-isoquinolin-2-yl)-5-oxo-pentyl]-1-piperidyl]sulfonyl]tetrahydropyran-4-carbohydroxamic acid CAS Name: 4-[[4-[5-(3,4-dihydro-1H-isoquinolin-2-yl)-5-oxopentyl]-1-piperidinyl]sulfonyl]-N-hydroxy-4-oxanecarboxamide IUPAC Name: 4-[4-[5-(3,4-dihydro-1H-isoquinolin-2-yl)-5-oxopentyl]piperidin-1-yl]sulfonyl-N-hydroxyoxane-4-carboxamide Traditional Name: 4-[4-[5-(3,4-dihydro-1H-isoquinolin-2-yl)-5-keto-pentyl]piperidino]sulfonyltetrahydropyran-4-carbohydroxamic acid Formula: C25H37N3O6S MolecularWeight: 507.64278

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CCCCC(=O)N2CCC3=CC=CC=C3C2)S(=O)(=O)C4(CCOCC4)C(=O)NO

Isomeric SMILES

C1CN(CCC1CCCCC(=O)N2CCC3=CC=CC=C3C2)S(=O)(=O)C4(CCOCC4)C(=O)NO

InChI

InChI=1S/C25H37N3O6S/c29-23(27-14-11-21-6-2-3-7-22(21)19-27)8-4-1-5-20-9-15-28(16-10-20)35(32,33)25(24(30)26-31)12-17-34-18-13-25/h2-3,6-7,20,31H,1,4-5,8-19H2,(H,26,30)