4-fluoranyl-N'-[1-[4-oxidanylidene-3-(piperidin-1-ium-1-ylmethyl)cyclohexa-2,5-dien-1-ylidene]ethyl]benzohydrazide

Systemtic Name: 4-fluoranyl-N'-[1-[4-oxidanylidene-3-(piperidin-1-ium-1-ylmethyl)cyclohexa-2,5-dien-1-ylidene]ethyl]benzohydrazide Openeye Name: 4-fluoro-N'-[1-[4-oxo-3-(piperidin-1-ium-1-ylmethyl)cyclohexa-2,5-dien-1-ylidene]ethyl]benzohydrazide CAS Name: 4-fluoro-N'-[1-[4-oxo-3-(1-piperidin-1-iumylmethyl)-1-cyclohexa-2,5-dienylidene]ethyl]benzohydrazide IUPAC Name: 4-fluoro-N'-[1-[4-oxo-3-(piperidin-1-ium-1-ylmethyl)cyclohexa-2,5-dien-1-ylidene]ethyl]benzohydrazide Traditional Name: 4-fluoro-N'-[1-[4-keto-3-(piperidin-1-ium-1-ylmethyl)cyclohexa-2,5-dien-1-ylidene]ethyl]benzohydrazide Formula: C21H25FN3O2+ MolecularWeight: 370.440503

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=C1C=CC(=O)C(=C1)C[NH+]2CCCCC2)NNC(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CC(=C1C=CC(=O)C(=C1)C[NH+]2CCCCC2)NNC(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H24FN3O2/c1-15(23-24-21(27)16-5-8-19(22)9-6-16)17-7-10-20(26)18(13-17)14-25-11-3-2-4-12-25/h5-10,13,23H,2-4,11-12,14H2,1H3,(H,24,27)/p+1