2-[[1-(4-methylpiperazin-1-yl)-2-phenyl-ethylidene]amino]-5-nitro-benzenecarbonitrile

Systemtic Name: 2-[[1-(4-methylpiperazin-1-yl)-2-phenyl-ethylidene]amino]-5-nitro-benzenecarbonitrile Openeye Name: 2-[[1-(4-methylpiperazin-1-yl)-2-phenyl-ethylidene]amino]-5-nitro-benzonitrile CAS Name: 2-[[1-(4-methyl-1-piperazinyl)-2-phenylethylidene]amino]-5-nitrobenzonitrile IUPAC Name: 2-[[1-(4-methylpiperazin-1-yl)-2-phenylethylidene]amino]-5-nitrobenzonitrile Traditional Name: 2-[[1-(4-methylpiperazino)-2-phenyl-ethylidene]amino]-5-nitro-benzonitrile Formula: C20H21N5O2 MolecularWeight: 363.41304

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=NC2=C(C=C(C=C2)[N+](=O)[O-])C#N)CC3=CC=CC=C3

Isomeric SMILES

CN1CCN(CC1)C(=NC2=C(C=C(C=C2)[N+](=O)[O-])C#N)CC3=CC=CC=C3

InChI

InChI=1S/C20H21N5O2/c1-23-9-11-24(12-10-23)20(13-16-5-3-2-4-6-16)22-19-8-7-18(25(26)27)14-17(19)15-21/h2-8,14H,9-13H2,1H3