3-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N-oxidanyl-3-oxidanylidene-2-(phenylmethyl)propanamide

Systemtic Name: 3-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N-oxidanyl-3-oxidanylidene-2-(phenylmethyl)propanamide Openeye Name: 3-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-benzyl-3-oxo-propanehydroxamic acid CAS Name: 3-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-N-hydroxy-3-oxo-2-(phenylmethyl)propanamide IUPAC Name: 3-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-benzyl-N-hydroxy-3-oxopropanamide Traditional Name: 2-benzyl-3-keto-3-(4-piperonylpiperazino)propanehydroxamic acid Formula: C22H25N3O5 MolecularWeight: 411.451

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)C(CC4=CC=CC=C4)C(=O)NO

Isomeric SMILES

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)C(CC4=CC=CC=C4)C(=O)NO

InChI

InChI=1S/C22H25N3O5/c26-21(23-28)18(12-16-4-2-1-3-5-16)22(27)25-10-8-24(9-11-25)14-17-6-7-19-20(13-17)30-15-29-19/h1-7,13,18,28H,8-12,14-15H2,(H,23,26)