2-[[4-[2-cyanoethyl-(2-methoxy-3-phenoxy-propyl)amino]phenyl]diazenyl]-5-nitro-benzenecarbonitrile

Systemtic Name: 2-[[4-[2-cyanoethyl-(2-methoxy-3-phenoxy-propyl)amino]phenyl]diazenyl]-5-nitro-benzenecarbonitrile Openeye Name: 2-[4-[2-cyanoethyl-(2-methoxy-3-phenoxy-propyl)amino]phenyl]azo-5-nitro-benzonitrile CAS Name: 2-[4-[2-cyanoethyl-(2-methoxy-3-phenoxypropyl)amino]phenyl]azo-5-nitrobenzonitrile IUPAC Name: 2-[[4-[2-cyanoethyl-(2-methoxy-3-phenoxypropyl)amino]phenyl]diazenyl]-5-nitrobenzonitrile Traditional Name: 2-[4-[2-cyanoethyl-(2-methoxy-3-phenoxy-propyl)amino]phenyl]azo-5-nitro-benzonitrile Formula: C26H24N6O4 MolecularWeight: 484.50656

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Descriptors Computed from Structure

Canonical SMILES:

COC(CN(CCC#N)C1=CC=C(C=C1)N=NC2=C(C=C(C=C2)[N+](=O)[O-])C#N)COC3=CC=CC=C3

Isomeric SMILES

COC(CN(CCC#N)C1=CC=C(C=C1)N=NC2=C(C=C(C=C2)[N+](=O)[O-])C#N)COC3=CC=CC=C3

InChI

InChI=1S/C26H24N6O4/c1-35-25(19-36-24-6-3-2-4-7-24)18-31(15-5-14-27)22-10-8-21(9-11-22)29-30-26-13-12-23(32(33)34)16-20(26)17-28/h2-4,6-13,16,25H,5,15,18-19H2,1H3