3-[4-(3-cyano-2-phenyl-azulen-1-yl)buta-1,3-diynyl]-2-phenyl-azulene-1-carbonitrile

Systemtic Name: 3-[4-(3-cyano-2-phenyl-azulen-1-yl)buta-1,3-diynyl]-2-phenyl-azulene-1-carbonitrile Openeye Name: 3-[4-(3-cyano-2-phenyl-azulen-1-yl)buta-1,3-diynyl]-2-phenyl-azulene-1-carbonitrile CAS Name: 3-[4-(3-cyano-2-phenyl-1-azulenyl)buta-1,3-diynyl]-2-phenyl-1-azulenecarbonitrile IUPAC Name: 3-[4-(3-cyano-2-phenylazulen-1-yl)buta-1,3-diynyl]-2-phenylazulene-1-carbonitrile Traditional Name: 3-[4-(3-cyano-2-phenyl-azulen-1-yl)buta-1,3-diynyl]-2-phenyl-azulene-1-carbonitrile Formula: C38H20N2 MolecularWeight: 504.5788

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C3=CC=CC=CC3=C2C#N)C#CC#CC4=C(C(=C5C4=CC=CC=C5)C#N)C6=CC=CC=C6

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C3=CC=CC=CC3=C2C#N)C#CC#CC4=C(C(=C5C4=CC=CC=C5)C#N)C6=CC=CC=C6

InChI

InChI=1S/C38H20N2/c39-25-35-31-21-11-3-9-19-29(31)33(37(35)27-15-5-1-6-16-27)23-13-14-24-34-30-20-10-4-12-22-32(30)36(26-40)38(34)28-17-7-2-8-18-28/h1-12,15-22H