4-[2-(4-methylpiperazin-1-yl)ethylamino]-3-nitro-benzenecarbonitrile

Systemtic Name: 4-[2-(4-methylpiperazin-1-yl)ethylamino]-3-nitro-benzenecarbonitrile Openeye Name: 4-[2-(4-methylpiperazin-1-yl)ethylamino]-3-nitro-benzonitrile CAS Name: 4-[2-(4-methyl-1-piperazinyl)ethylamino]-3-nitrobenzonitrile IUPAC Name: 4-[2-(4-methylpiperazin-1-yl)ethylamino]-3-nitrobenzonitrile Traditional Name: 4-[2-(4-methylpiperazino)ethylamino]-3-nitro-benzonitrile Formula: C14H19N5O2 MolecularWeight: 289.33296

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CCNC2=C(C=C(C=C2)C#N)[N+](=O)[O-]

Isomeric SMILES

CN1CCN(CC1)CCNC2=C(C=C(C=C2)C#N)[N+](=O)[O-]

InChI

InChI=1S/C14H19N5O2/c1-17-6-8-18(9-7-17)5-4-16-13-3-2-12(11-15)10-14(13)19(20)21/h2-3,10,16H,4-9H2,1H3