2-(3-methoxypropylamino)-5-nitro-benzenecarbonitrile

Systemtic Name: 2-(3-methoxypropylamino)-5-nitro-benzenecarbonitrile Openeye Name: 2-(3-methoxypropylamino)-5-nitro-benzonitrile CAS Name: 2-(3-methoxypropylamino)-5-nitrobenzonitrile IUPAC Name: 2-(3-methoxypropylamino)-5-nitrobenzonitrile Traditional Name: 2-(3-methoxypropylamino)-5-nitro-benzonitrile Formula: C11H13N3O3 MolecularWeight: 235.23922

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Descriptors Computed from Structure

Canonical SMILES:

COCCCNC1=C(C=C(C=C1)[N+](=O)[O-])C#N

Isomeric SMILES

COCCCNC1=C(C=C(C=C1)[N+](=O)[O-])C#N

InChI

InChI=1S/C11H13N3O3/c1-17-6-2-5-13-11-4-3-10(14(15)16)7-9(11)8-12/h3-4,7,13H,2,5-6H2,1H3