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

Systemtic Name: N'-[1-[4-oxidanylidene-3-(piperidin-1-ium-1-ylmethyl)cyclohexa-2,5-dien-1-ylidene]ethyl]benzohydrazide Openeye Name: N'-[1-[4-oxo-3-(piperidin-1-ium-1-ylmethyl)cyclohexa-2,5-dien-1-ylidene]ethyl]benzohydrazide CAS Name: N'-[1-[4-oxo-3-(1-piperidin-1-iumylmethyl)-1-cyclohexa-2,5-dienylidene]ethyl]benzohydrazide IUPAC Name: N'-[1-[4-oxo-3-(piperidin-1-ium-1-ylmethyl)cyclohexa-2,5-dien-1-ylidene]ethyl]benzohydrazide Traditional Name: N'-[1-[4-keto-3-(piperidin-1-ium-1-ylmethyl)cyclohexa-2,5-dien-1-ylidene]ethyl]benzohydrazide Formula: C21H26N3O2+ MolecularWeight: 352.45004

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25N3O2/c1-16(22-23-21(26)17-8-4-2-5-9-17)18-10-11-20(25)19(14-18)15-24-12-6-3-7-13-24/h2,4-5,8-11,14,22H,3,6-7,12-13,15H2,1H3,(H,23,26)/p+1