5-nitro-2-(octylamino)benzenecarbonitrile

Systemtic Name: 5-nitro-2-(octylamino)benzenecarbonitrile Openeye Name: 5-nitro-2-(octylamino)benzonitrile CAS Name: 5-nitro-2-(octylamino)benzonitrile IUPAC Name: 5-nitro-2-(octylamino)benzonitrile Traditional Name: 5-nitro-2-(octylamino)benzonitrile Formula: C15H21N3O2 MolecularWeight: 275.34614

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCNC1=C(C=C(C=C1)[N+](=O)[O-])C#N

Isomeric SMILES

CCCCCCCCNC1=C(C=C(C=C1)[N+](=O)[O-])C#N

InChI

InChI=1S/C15H21N3O2/c1-2-3-4-5-6-7-10-17-15-9-8-14(18(19)20)11-13(15)12-16/h8-9,11,17H,2-7,10H2,1H3