2-[2-[2-(cyclohexylamino)-4-methyl-pyridin-1-ium-1-yl]-2-oxidanylidene-ethoxy]benzenecarbonitrile

Systemtic Name: 2-[2-[2-(cyclohexylamino)-4-methyl-pyridin-1-ium-1-yl]-2-oxidanylidene-ethoxy]benzenecarbonitrile Openeye Name: 2-[2-[2-(cyclohexylamino)-4-methyl-pyridin-1-ium-1-yl]-2-oxo-ethoxy]benzonitrile CAS Name: 2-[2-[2-(cyclohexylamino)-4-methyl-1-pyridin-1-iumyl]-2-oxoethoxy]benzonitrile IUPAC Name: 2-[2-[2-(cyclohexylamino)-4-methylpyridin-1-ium-1-yl]-2-oxoethoxy]benzonitrile Traditional Name: 2-[2-[2-(cyclohexylamino)-4-methyl-pyridin-1-ium-1-yl]-2-keto-ethoxy]benzonitrile Formula: C21H24N3O2+ MolecularWeight: 350.43416

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[N+](C=C1)C(=O)COC2=CC=CC=C2C#N)NC3CCCCC3

Isomeric SMILES

CC1=CC(=[N+](C=C1)C(=O)COC2=CC=CC=C2C#N)NC3CCCCC3

InChI

InChI=1S/C21H23N3O2/c1-16-11-12-24(20(13-16)23-18-8-3-2-4-9-18)21(25)15-26-19-10-6-5-7-17(19)14-22/h5-7,10-13,18H,2-4,8-9,15H2,1H3/p+1