1-ethyl-6-methyl-4-(4-methylpiperazin-4-ium-1-yl)-2-oxidanylidene-pyridine-3-carbonitrile

Systemtic Name: 1-ethyl-6-methyl-4-(4-methylpiperazin-4-ium-1-yl)-2-oxidanylidene-pyridine-3-carbonitrile Openeye Name: 1-ethyl-6-methyl-4-(4-methylpiperazin-4-ium-1-yl)-2-oxo-pyridine-3-carbonitrile CAS Name: 1-ethyl-6-methyl-4-(4-methyl-1-piperazin-4-iumyl)-2-oxo-3-pyridinecarbonitrile IUPAC Name: 1-ethyl-6-methyl-4-(4-methylpiperazin-4-ium-1-yl)-2-oxopyridine-3-carbonitrile Traditional Name: 1-ethyl-2-keto-6-methyl-4-(4-methylpiperazin-4-ium-1-yl)nicotinonitrile Formula: C14H21N4O+ MolecularWeight: 261.34274

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC(=C(C1=O)C#N)N2CC[NH+](CC2)C)C

Isomeric SMILES

CCN1C(=CC(=C(C1=O)C#N)N2CC[NH+](CC2)C)C

InChI

InChI=1S/C14H20N4O/c1-4-18-11(2)9-13(12(10-15)14(18)19)17-7-5-16(3)6-8-17/h9H,4-8H2,1-3H3/p+1