4-[4-[4-(6,7-diethyl-3,4-dihydro-1H-isoquinolin-2-yl)butoxy]phenyl]sulfonyl-N-oxidanyl-oxane-4-carboxamide

Systemtic Name: 4-[4-[4-(6,7-diethyl-3,4-dihydro-1H-isoquinolin-2-yl)butoxy]phenyl]sulfonyl-N-oxidanyl-oxane-4-carboxamide Openeye Name: 4-[4-[4-(6,7-diethyl-3,4-dihydro-1H-isoquinolin-2-yl)butoxy]phenyl]sulfonyltetrahydropyran-4-carbohydroxamic acid CAS Name: 4-[4-[4-(6,7-diethyl-3,4-dihydro-1H-isoquinolin-2-yl)butoxy]phenyl]sulfonyl-N-hydroxy-4-oxanecarboxamide IUPAC Name: 4-[4-[4-(6,7-diethyl-3,4-dihydro-1H-isoquinolin-2-yl)butoxy]phenyl]sulfonyl-N-hydroxyoxane-4-carboxamide Traditional Name: 4-[4-[4-(6,7-diethyl-3,4-dihydro-1H-isoquinolin-2-yl)butoxy]phenyl]sulfonyltetrahydropyran-4-carbohydroxamic acid Formula: C29H40N2O6S MolecularWeight: 544.7027

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2CN(CCC2=C1)CCCCOC3=CC=C(C=C3)S(=O)(=O)C4(CCOCC4)C(=O)NO)CC

Isomeric SMILES

CCC1=C(C=C2CN(CCC2=C1)CCCCOC3=CC=C(C=C3)S(=O)(=O)C4(CCOCC4)C(=O)NO)CC

InChI

InChI=1S/C29H40N2O6S/c1-3-22-19-24-11-15-31(21-25(24)20-23(22)4-2)14-5-6-16-37-26-7-9-27(10-8-26)38(34,35)29(28(32)30-33)12-17-36-18-13-29/h7-10,19-20,33H,3-6,11-18,21H2,1-2H3,(H,30,32)