4-[bis(3-phenylprop-2-ynyl)azaniumyl]butyl-bis(3-phenylprop-2-ynyl)azanium

Systemtic Name: 4-[bis(3-phenylprop-2-ynyl)azaniumyl]butyl-bis(3-phenylprop-2-ynyl)azanium Openeye Name: 4-[bis(3-phenylprop-2-ynyl)ammonio]butyl-bis(3-phenylprop-2-ynyl)ammonium CAS Name: 4-[bis(3-phenylprop-2-ynyl)ammonio]butyl-bis(3-phenylprop-2-ynyl)ammonium IUPAC Name: 4-[bis(3-phenylprop-2-ynyl)azaniumyl]butyl-bis(3-phenylprop-2-ynyl)azanium Traditional Name: 4-[bis(3-phenylprop-2-ynyl)ammonio]butyl-bis(3-phenylprop-2-ynyl)ammonium Formula: C40H38N2+2 MolecularWeight: 546.74312

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C#CC[NH+](CCCC[NH+](CC#CC2=CC=CC=C2)CC#CC3=CC=CC=C3)CC#CC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C#CC[NH+](CCCC[NH+](CC#CC2=CC=CC=C2)CC#CC3=CC=CC=C3)CC#CC4=CC=CC=C4

InChI

InChI=1S/C40H36N2/c1-5-19-37(20-6-1)27-15-33-41(34-16-28-38-21-7-2-8-22-38)31-13-14-32-42(35-17-29-39-23-9-3-10-24-39)36-18-30-40-25-11-4-12-26-40/h1-12,19-26H,13-14,31-36H2/p+2