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

Systemtic Name: 3-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N-oxidanyl-3-oxidanylidene-2-[(3-phenoxyphenyl)methyl]propanamide Openeye Name: 3-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-3-oxo-2-[(3-phenoxyphenyl)methyl]propanehydroxamic acid CAS Name: 3-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-N-hydroxy-3-oxo-2-[(3-phenoxyphenyl)methyl]propanamide IUPAC Name: 3-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N-hydroxy-3-oxo-2-[(3-phenoxyphenyl)methyl]propanamide Traditional Name: 3-keto-2-(3-phenoxybenzyl)-3-(4-piperonylpiperazino)propanehydroxamic acid Formula: C28H29N3O6 MolecularWeight: 503.54636

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)OC5=CC=CC=C5)C(=O)NO

Isomeric SMILES

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)C(CC4=CC(=CC=C4)OC5=CC=CC=C5)C(=O)NO

InChI

InChI=1S/C28H29N3O6/c32-27(29-34)24(16-20-5-4-8-23(15-20)37-22-6-2-1-3-7-22)28(33)31-13-11-30(12-14-31)18-21-9-10-25-26(17-21)36-19-35-25/h1-10,15,17,24,34H,11-14,16,18-19H2,(H,29,32)