4-[2-[4-[2-(4-aminophenyl)ethynyl]-2,5-dinitro-phenyl]ethynyl]aniline

Systemtic Name: 4-[2-[4-[2-(4-aminophenyl)ethynyl]-2,5-dinitro-phenyl]ethynyl]aniline Openeye Name: 4-[2-[4-[2-(4-aminophenyl)ethynyl]-2,5-dinitro-phenyl]ethynyl]aniline CAS Name: 4-[2-[4-[2-(4-aminophenyl)ethynyl]-2,5-dinitrophenyl]ethynyl]aniline IUPAC Name: 4-[2-[4-[2-(4-aminophenyl)ethynyl]-2,5-dinitrophenyl]ethynyl]aniline Traditional Name: [4-[2-[4-[2-(4-aminophenyl)ethynyl]-2,5-dinitro-phenyl]ethynyl]phenyl]amine Formula: C22H14N4O4 MolecularWeight: 398.37096

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#CC2=CC(=C(C=C2[N+](=O)[O-])C#CC3=CC=C(C=C3)N)[N+](=O)[O-])N

Isomeric SMILES

C1=CC(=CC=C1C#CC2=CC(=C(C=C2[N+](=O)[O-])C#CC3=CC=C(C=C3)N)[N+](=O)[O-])N

InChI

InChI=1S/C22H14N4O4/c23-19-9-3-15(4-10-19)1-7-17-13-22(26(29)30)18(14-21(17)25(27)28)8-2-16-5-11-20(24)12-6-16/h3-6,9-14H,23-24H2