2,6-bis(2,2-dimethoxyethylamino)-3-nitro-benzenecarbonitrile

Systemtic Name: 2,6-bis(2,2-dimethoxyethylamino)-3-nitro-benzenecarbonitrile Openeye Name: 2,6-bis(2,2-dimethoxyethylamino)-3-nitro-benzonitrile CAS Name: 2,6-bis(2,2-dimethoxyethylamino)-3-nitrobenzonitrile IUPAC Name: 2,6-bis(2,2-dimethoxyethylamino)-3-nitrobenzonitrile Traditional Name: 2,6-bis(2,2-dimethoxyethylamino)-3-nitro-benzonitrile Formula: C15H22N4O6 MolecularWeight: 354.35838

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Descriptors Computed from Structure

Canonical SMILES:

COC(CNC1=C(C(=C(C=C1)[N+](=O)[O-])NCC(OC)OC)C#N)OC

Isomeric SMILES

COC(CNC1=C(C(=C(C=C1)[N+](=O)[O-])NCC(OC)OC)C#N)OC

InChI

InChI=1S/C15H22N4O6/c1-22-13(23-2)8-17-11-5-6-12(19(20)21)15(10(11)7-16)18-9-14(24-3)25-4/h5-6,13-14,17-18H,8-9H2,1-4H3