N'-[(E)-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]-3-(4-phenylpiperazin-1-ium-1-yl)propanehydrazide

Systemtic Name: N'-[(E)-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]-3-(4-phenylpiperazin-1-ium-1-yl)propanehydrazide Openeye Name: N'-[(E)-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]-3-(4-phenylpiperazin-1-ium-1-yl)propanehydrazide CAS Name: N'-[(E)-3-(1,3-benzodioxol-5-yl)-1-oxoprop-2-enyl]-3-(4-phenyl-1-piperazin-1-iumyl)propanehydrazide IUPAC Name: N'-[(E)-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]-3-(4-phenylpiperazin-1-ium-1-yl)propanehydrazide Traditional Name: N'-[(E)-3-(1,3-benzodioxol-5-yl)acryloyl]-3-(4-phenylpiperazin-1-ium-1-yl)propionohydrazide Formula: C23H27N4O4+ MolecularWeight: 423.48488

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCC(=O)NNC(=O)C=CC2=CC3=C(C=C2)OCO3)C4=CC=CC=C4

Isomeric SMILES

C1CN(CC[NH+]1CCC(=O)NNC(=O)/C=C/C2=CC3=C(C=C2)OCO3)C4=CC=CC=C4

InChI

InChI=1S/C23H26N4O4/c28-22(9-7-18-6-8-20-21(16-18)31-17-30-20)24-25-23(29)10-11-26-12-14-27(15-13-26)19-4-2-1-3-5-19/h1-9,16H,10-15,17H2,(H,24,28)(H,25,29)/p+1/b9-7+