(2Z)-2-[(4-ethylphenyl)hydrazinylidene]-3-(4-methylpiperazin-4-ium-1-yl)-3-oxidanylidene-propanenitrile

Systemtic Name: (2Z)-2-[(4-ethylphenyl)hydrazinylidene]-3-(4-methylpiperazin-4-ium-1-yl)-3-oxidanylidene-propanenitrile Openeye Name: (1Z)-N-(4-ethylanilino)-2-(4-methylpiperazin-4-ium-1-yl)-2-oxo-acetimidoyl cyanide CAS Name: (2Z)-2-[(4-ethylphenyl)hydrazinylidene]-3-(4-methyl-1-piperazin-4-iumyl)-3-oxopropanenitrile IUPAC Name: (1Z)-N-(4-ethylanilino)-2-(4-methylpiperazin-4-ium-1-yl)-2-oxoethanimidoyl cyanide Traditional Name: (2Z)-2-[(4-ethylphenyl)hydrazono]-3-keto-3-(4-methylpiperazin-4-ium-1-yl)propionitrile Formula: C16H22N5O+ MolecularWeight: 300.37878

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NN=C(C#N)C(=O)N2CC[NH+](CC2)C

Isomeric SMILES

CCC1=CC=C(C=C1)N/N=C(/C#N)\C(=O)N2CC[NH+](CC2)C

InChI

InChI=1S/C16H21N5O/c1-3-13-4-6-14(7-5-13)18-19-15(12-17)16(22)21-10-8-20(2)9-11-21/h4-7,18H,3,8-11H2,1-2H3/p+1/b19-15-