1-(4-methylphenyl)-2-[4-[oxidanyl-[(phenylmethyl)amino]methylidene]-1H-pyridin-1-ium-1-yl]ethanone

Systemtic Name: 1-(4-methylphenyl)-2-[4-[oxidanyl-[(phenylmethyl)amino]methylidene]-1H-pyridin-1-ium-1-yl]ethanone Openeye Name: 2-[4-[(benzylamino)-hydroxy-methylene]-1H-pyridin-1-ium-1-yl]-1-(p-tolyl)ethanone CAS Name: 2-[4-[hydroxy-[(phenylmethyl)amino]methylidene]-1H-pyridin-1-ium-1-yl]-1-(4-methylphenyl)ethanone IUPAC Name: 2-[4-[(benzylamino)-hydroxymethylidene]-1H-pyridin-1-ium-1-yl]-1-(4-methylphenyl)ethanone Traditional Name: 2-[4-[(benzylamino)-hydroxy-methylene]-1H-pyridin-1-ium-1-yl]-1-(p-tolyl)ethanone Formula: C22H23N2O2+ MolecularWeight: 347.43022

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C[NH+]2C=CC(=C(NCC3=CC=CC=C3)O)C=C2

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C[NH+]2C=CC(=C(NCC3=CC=CC=C3)O)C=C2

InChI

InChI=1S/C22H22N2O2/c1-17-7-9-19(10-8-17)21(25)16-24-13-11-20(12-14-24)22(26)23-15-18-5-3-2-4-6-18/h2-14,23,26H,15-16H2,1H3/p+1