2-[(Z)-3-(4-bromophenyl)-3-(4-methylpiperazin-4-ium-1-yl)prop-2-enylidene]propanedinitrile

Systemtic Name: 2-[(Z)-3-(4-bromophenyl)-3-(4-methylpiperazin-4-ium-1-yl)prop-2-enylidene]propanedinitrile Openeye Name: 2-[(Z)-3-(4-bromophenyl)-3-(4-methylpiperazin-4-ium-1-yl)prop-2-enylidene]propanedinitrile CAS Name: 2-[(Z)-3-(4-bromophenyl)-3-(4-methyl-1-piperazin-4-iumyl)prop-2-enylidene]propanedinitrile IUPAC Name: 2-[(Z)-3-(4-bromophenyl)-3-(4-methylpiperazin-4-ium-1-yl)prop-2-enylidene]propanedinitrile Traditional Name: 2-[(Z)-3-(4-bromophenyl)-3-(4-methylpiperazin-4-ium-1-yl)prop-2-enylidene]malononitrile Formula: C17H18BrN4+ MolecularWeight: 358.25562

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(=CC=C(C#N)C#N)C2=CC=C(C=C2)Br

Isomeric SMILES

C[NH+]1CCN(CC1)/C(=C\C=C(C#N)C#N)/C2=CC=C(C=C2)Br

InChI

InChI=1S/C17H17BrN4/c1-21-8-10-22(11-9-21)17(7-2-14(12-19)13-20)15-3-5-16(18)6-4-15/h2-7H,8-11H2,1H3/p+1/b17-7-