4-(methoxymethyl)-6-methyl-2-[(phenylmethyl)amino]pyridin-1-ium-3-carbonitrile

Systemtic Name: 4-(methoxymethyl)-6-methyl-2-[(phenylmethyl)amino]pyridin-1-ium-3-carbonitrile Openeye Name: 2-(benzylamino)-4-(methoxymethyl)-6-methyl-pyridin-1-ium-3-carbonitrile CAS Name: 4-(methoxymethyl)-6-methyl-2-[(phenylmethyl)amino]-3-pyridin-1-iumcarbonitrile IUPAC Name: 2-(benzylamino)-4-(methoxymethyl)-6-methylpyridin-1-ium-3-carbonitrile Traditional Name: 2-(benzylamino)-4-(methoxymethyl)-6-methyl-pyridin-1-ium-3-carbonitrile Formula: C16H18N3O+ MolecularWeight: 268.33362

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[NH+]C(=C(C(=C1)COC)C#N)NCC2=CC=CC=C2

Isomeric SMILES

CC1=[NH+]C(=C(C(=C1)COC)C#N)NCC2=CC=CC=C2

InChI

InChI=1S/C16H17N3O/c1-12-8-14(11-20-2)15(9-17)16(19-12)18-10-13-6-4-3-5-7-13/h3-8H,10-11H2,1-2H3,(H,18,19)/p+1