4-[[4,7-bis[(4-cyanophenyl)diazenyl]-1,4,7-triazonan-1-yl]diazenyl]benzenecarbonitrile

Systemtic Name: 4-[[4,7-bis[(4-cyanophenyl)diazenyl]-1,4,7-triazonan-1-yl]diazenyl]benzenecarbonitrile Openeye Name: 4-[[4,7-bis[(4-cyanophenyl)azo]-1,4,7-triazonan-1-yl]azo]benzonitrile CAS Name: 4-[[4,7-bis[(4-cyanophenyl)azo]-1,4,7-triazonan-1-yl]azo]benzonitrile IUPAC Name: 4-[[4,7-bis[(4-cyanophenyl)diazenyl]-1,4,7-triazonan-1-yl]diazenyl]benzonitrile Traditional Name: 4-[[4,7-bis[(4-cyanophenyl)azo]-1,4,7-triazonan-1-yl]azo]benzonitrile Formula: C27H24N12 MolecularWeight: 516.55986

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(CCN1N=NC2=CC=C(C=C2)C#N)N=NC3=CC=C(C=C3)C#N)N=NC4=CC=C(C=C4)C#N

Isomeric SMILES

C1CN(CCN(CCN1N=NC2=CC=C(C=C2)C#N)N=NC3=CC=C(C=C3)C#N)N=NC4=CC=C(C=C4)C#N

InChI

InChI=1S/C27H24N12/c28-19-22-1-7-25(8-2-22)31-34-37-13-15-38(35-32-26-9-3-23(20-29)4-10-26)17-18-39(16-14-37)36-33-27-11-5-24(21-30)6-12-27/h1-12H,13-18H2