4-[1-[2-(4-methylphenyl)hydrazinyl]ethylidene]-2-(piperidin-1-ium-1-ylmethyl)cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[1-[2-(4-methylphenyl)hydrazinyl]ethylidene]-2-(piperidin-1-ium-1-ylmethyl)cyclohexa-2,5-dien-1-one Openeye Name: 2-(piperidin-1-ium-1-ylmethyl)-4-[1-[2-(p-tolyl)hydrazino]ethylidene]cyclohexa-2,5-dien-1-one CAS Name: 4-[1-[(4-methylphenyl)hydrazo]ethylidene]-2-(1-piperidin-1-iumylmethyl)-1-cyclohexa-2,5-dienone IUPAC Name: 4-[1-[2-(4-methylphenyl)hydrazinyl]ethylidene]-2-(piperidin-1-ium-1-ylmethyl)cyclohexa-2,5-dien-1-one Traditional Name: 2-(piperidin-1-ium-1-ylmethyl)-4-[1-[N'-(p-tolyl)hydrazino]ethylidene]cyclohexa-2,5-dien-1-one Formula: C21H28N3O+ MolecularWeight: 338.46652

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NNC(=C2C=CC(=O)C(=C2)C[NH+]3CCCCC3)C

Isomeric SMILES

CC1=CC=C(C=C1)NNC(=C2C=CC(=O)C(=C2)C[NH+]3CCCCC3)C

InChI

InChI=1S/C21H27N3O/c1-16-6-9-20(10-7-16)23-22-17(2)18-8-11-21(25)19(14-18)15-24-12-4-3-5-13-24/h6-11,14,22-23H,3-5,12-13,15H2,1-2H3/p+1