2-[[4-[2-cyanoethyl(2-hydroxyethyl)amino]phenyl]diazenyl]-5-nitro-benzenecarbonitrile

Systemtic Name: 2-[[4-[2-cyanoethyl(2-hydroxyethyl)amino]phenyl]diazenyl]-5-nitro-benzenecarbonitrile Openeye Name: 2-[4-[2-cyanoethyl(2-hydroxyethyl)amino]phenyl]azo-5-nitro-benzonitrile CAS Name: 2-[4-[2-cyanoethyl(2-hydroxyethyl)amino]phenyl]azo-5-nitrobenzonitrile IUPAC Name: 2-[[4-[2-cyanoethyl(2-hydroxyethyl)amino]phenyl]diazenyl]-5-nitrobenzonitrile Traditional Name: 2-[4-[2-cyanoethyl(2-hydroxyethyl)amino]phenyl]azo-5-nitro-benzonitrile Formula: C18H16N6O3 MolecularWeight: 364.35804

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N=NC2=C(C=C(C=C2)[N+](=O)[O-])C#N)N(CCC#N)CCO

Isomeric SMILES

C1=CC(=CC=C1N=NC2=C(C=C(C=C2)[N+](=O)[O-])C#N)N(CCC#N)CCO

InChI

InChI=1S/C18H16N6O3/c19-8-1-9-23(10-11-25)16-4-2-15(3-5-16)21-22-18-7-6-17(24(26)27)12-14(18)13-20/h2-7,12,25H,1,9-11H2