2-[(4-fluorophenyl)methoxy]-N'-[3-(4-phenylpiperazin-1-ium-1-yl)propanoyl]benzohydrazide

Systemtic Name: 2-[(4-fluorophenyl)methoxy]-N'-[3-(4-phenylpiperazin-1-ium-1-yl)propanoyl]benzohydrazide Openeye Name: 2-[(4-fluorophenyl)methoxy]-N'-[3-(4-phenylpiperazin-1-ium-1-yl)propanoyl]benzohydrazide CAS Name: 2-[(4-fluorophenyl)methoxy]-N'-[1-oxo-3-(4-phenyl-1-piperazin-1-iumyl)propyl]benzohydrazide IUPAC Name: 2-[(4-fluorophenyl)methoxy]-N'-[3-(4-phenylpiperazin-1-ium-1-yl)propanoyl]benzohydrazide Traditional Name: 2-(4-fluorobenzyl)oxy-N'-[3-(4-phenylpiperazin-1-ium-1-yl)propanoyl]benzohydrazide Formula: C27H30FN4O3+ MolecularWeight: 477.550503

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCC(=O)NNC(=O)C2=CC=CC=C2OCC3=CC=C(C=C3)F)C4=CC=CC=C4

Isomeric SMILES

C1CN(CC[NH+]1CCC(=O)NNC(=O)C2=CC=CC=C2OCC3=CC=C(C=C3)F)C4=CC=CC=C4

InChI

InChI=1S/C27H29FN4O3/c28-22-12-10-21(11-13-22)20-35-25-9-5-4-8-24(25)27(34)30-29-26(33)14-15-31-16-18-32(19-17-31)23-6-2-1-3-7-23/h1-13H,14-20H2,(H,29,33)(H,30,34)/p+1