4-[[2-(diethylamino)-4-methyl-pentyl]amino]-3-nitro-benzenecarbonitrile

Systemtic Name: 4-[[2-(diethylamino)-4-methyl-pentyl]amino]-3-nitro-benzenecarbonitrile Openeye Name: 4-[[2-(diethylamino)-4-methyl-pentyl]amino]-3-nitro-benzonitrile CAS Name: 4-[[2-(diethylamino)-4-methylpentyl]amino]-3-nitrobenzonitrile IUPAC Name: 4-[[2-(diethylamino)-4-methylpentyl]amino]-3-nitrobenzonitrile Traditional Name: 4-[[2-(diethylamino)-4-methyl-pentyl]amino]-3-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)C#N)[N+](=O)[O-]

Isomeric SMILES

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

InChI

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