2-[[2-(diethylamino)-4-methyl-pentyl]amino]-5-nitro-benzenecarbonitrile

Systemtic Name: 2-[[2-(diethylamino)-4-methyl-pentyl]amino]-5-nitro-benzenecarbonitrile Openeye Name: 2-[[2-(diethylamino)-4-methyl-pentyl]amino]-5-nitro-benzonitrile CAS Name: 2-[[2-(diethylamino)-4-methylpentyl]amino]-5-nitrobenzonitrile IUPAC Name: 2-[[2-(diethylamino)-4-methylpentyl]amino]-5-nitrobenzonitrile Traditional Name: 2-[[2-(diethylamino)-4-methyl-pentyl]amino]-5-nitro-benzonitrile Formula: C17H26N4O2 MolecularWeight: 318.41394

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(CC(C)C)CNC1=C(C=C(C=C1)[N+](=O)[O-])C#N

Isomeric SMILES

CCN(CC)C(CC(C)C)CNC1=C(C=C(C=C1)[N+](=O)[O-])C#N

InChI

InChI=1S/C17H26N4O2/c1-5-20(6-2)16(9-13(3)4)12-19-17-8-7-15(21(22)23)10-14(17)11-18/h7-8,10,13,16,19H,5-6,9,12H2,1-4H3