3-[1,3-benzodioxol-5-ylmethyl-(4-butoxyphenyl)sulfonyl-amino]-N-oxidanyl-propanamide

Systemtic Name: 3-[1,3-benzodioxol-5-ylmethyl-(4-butoxyphenyl)sulfonyl-amino]-N-oxidanyl-propanamide Openeye Name: 3-[1,3-benzodioxol-5-ylmethyl-(4-butoxyphenyl)sulfonyl-amino]propanehydroxamic acid CAS Name: 3-[1,3-benzodioxol-5-ylmethyl-(4-butoxyphenyl)sulfonylamino]-N-hydroxypropanamide IUPAC Name: 3-[1,3-benzodioxol-5-ylmethyl-(4-butoxyphenyl)sulfonylamino]-N-hydroxypropanamide Traditional Name: 3-[(4-butoxyphenyl)sulfonyl-piperonyl-amino]propanehydroxamic acid Formula: C21H26N2O7S MolecularWeight: 450.50534

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)S(=O)(=O)N(CCC(=O)NO)CC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CCCCOC1=CC=C(C=C1)S(=O)(=O)N(CCC(=O)NO)CC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C21H26N2O7S/c1-2-3-12-28-17-5-7-18(8-6-17)31(26,27)23(11-10-21(24)22-25)14-16-4-9-19-20(13-16)30-15-29-19/h4-9,13,25H,2-3,10-12,14-15H2,1H3,(H,22,24)