3-[4-(phenylmethyl)piperazin-1-ium-1-yl]-N-propylsulfonyl-propanehydrazonate

Systemtic Name: 3-[4-(phenylmethyl)piperazin-1-ium-1-yl]-N-propylsulfonyl-propanehydrazonate Openeye Name: 3-(4-benzylpiperazin-1-ium-1-yl)-N-propylsulfonyl-propanehydrazonate CAS Name: 3-[4-(phenylmethyl)-1-piperazin-1-iumyl]-N-propylsulfonylpropanehydrazonate IUPAC Name: 3-(4-benzylpiperazin-1-ium-1-yl)-N-propylsulfonylpropanehydrazonate Traditional Name: 3-(4-benzylpiperazin-1-ium-1-yl)-N-propylsulfonyl-propionohydrazonate Formula: C17H28N4O3S MolecularWeight: 368.49422

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)NN=C(CC[NH+]1CCN(CC1)CC2=CC=CC=C2)[O-]

Isomeric SMILES

CCCS(=O)(=O)NN=C(CC[NH+]1CCN(CC1)CC2=CC=CC=C2)[O-]

InChI

InChI=1S/C17H28N4O3S/c1-2-14-25(23,24)19-18-17(22)8-9-20-10-12-21(13-11-20)15-16-6-4-3-5-7-16/h3-7,19H,2,8-15H2,1H3,(H,18,22)