6-(4-methoxyphenyl)-2-(piperidin-1-ium-4-ylamino)pyridine-3-carbonitrile

Systemtic Name: 6-(4-methoxyphenyl)-2-(piperidin-1-ium-4-ylamino)pyridine-3-carbonitrile Openeye Name: 6-(4-methoxyphenyl)-2-(piperidin-1-ium-4-ylamino)pyridine-3-carbonitrile CAS Name: 6-(4-methoxyphenyl)-2-(4-piperidin-1-iumylamino)-3-pyridinecarbonitrile IUPAC Name: 6-(4-methoxyphenyl)-2-(piperidin-1-ium-4-ylamino)pyridine-3-carbonitrile Traditional Name: 6-(4-methoxyphenyl)-2-(piperidin-1-ium-4-ylamino)nicotinonitrile Formula: C18H21N4O+ MolecularWeight: 309.38554

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NC(=C(C=C2)C#N)NC3CC[NH2+]CC3

Isomeric SMILES

COC1=CC=C(C=C1)C2=NC(=C(C=C2)C#N)NC3CC[NH2+]CC3

InChI

InChI=1S/C18H20N4O/c1-23-16-5-2-13(3-6-16)17-7-4-14(12-19)18(22-17)21-15-8-10-20-11-9-15/h2-7,15,20H,8-11H2,1H3,(H,21,22)/p+1