7-(1,3-benzodioxol-5-yl)-3-(3,4-dimethoxyphenyl)sulfonyl-N-oxidanyl-heptanamide

Systemtic Name: 7-(1,3-benzodioxol-5-yl)-3-(3,4-dimethoxyphenyl)sulfonyl-N-oxidanyl-heptanamide Openeye Name: 7-(1,3-benzodioxol-5-yl)-3-(3,4-dimethoxyphenyl)sulfonyl-heptanehydroxamic acid CAS Name: 7-(1,3-benzodioxol-5-yl)-3-(3,4-dimethoxyphenyl)sulfonyl-N-hydroxyheptanamide IUPAC Name: 7-(1,3-benzodioxol-5-yl)-3-(3,4-dimethoxyphenyl)sulfonyl-N-hydroxyheptanamide Traditional Name: 7-(1,3-benzodioxol-5-yl)-3-(3,4-dimethoxyphenyl)sulfonyl-heptanehydroxamic acid Formula: C22H27NO8S MolecularWeight: 465.51668

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)C(CCCCC2=CC3=C(C=C2)OCO3)CC(=O)NO)OC

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)C(CCCCC2=CC3=C(C=C2)OCO3)CC(=O)NO)OC

InChI

InChI=1S/C22H27NO8S/c1-28-18-10-8-17(12-20(18)29-2)32(26,27)16(13-22(24)23-25)6-4-3-5-15-7-9-19-21(11-15)31-14-30-19/h7-12,16,25H,3-6,13-14H2,1-2H3,(H,23,24)