N-oxidanyl-2-(4-pyridin-4-yloxyphenyl)sulfonyl-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinoline-1-carboxamide

Systemtic Name: N-oxidanyl-2-(4-pyridin-4-yloxyphenyl)sulfonyl-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinoline-1-carboxamide Openeye Name: 2-[4-(4-pyridyloxy)phenyl]sulfonyl-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinoline-1-carbohydroxamic acid CAS Name: N-hydroxy-2-(4-pyridin-4-yloxyphenyl)sulfonyl-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinoline-1-carboxamide IUPAC Name: N-hydroxy-2-(4-pyridin-4-yloxyphenyl)sulfonyl-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinoline-1-carboxamide Traditional Name: 2-[4-(4-pyridyloxy)phenyl]sulfonyl-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinoline-1-carbohydroxamic acid Formula: C21H25N3O5S MolecularWeight: 431.5053

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2C(C1)CCN(C2C(=O)NO)S(=O)(=O)C3=CC=C(C=C3)OC4=CC=NC=C4

Isomeric SMILES

C1CCC2C(C1)CCN(C2C(=O)NO)S(=O)(=O)C3=CC=C(C=C3)OC4=CC=NC=C4

InChI

InChI=1S/C21H25N3O5S/c25-21(23-26)20-19-4-2-1-3-15(19)11-14-24(20)30(27,28)18-7-5-16(6-8-18)29-17-9-12-22-13-10-17/h5-10,12-13,15,19-20,26H,1-4,11,14H2,(H,23,25)