4-[2-(1,10-phenanthrolin-2-yl)ethynyl]aniline

Systemtic Name: 4-[2-(1,10-phenanthrolin-2-yl)ethynyl]aniline Openeye Name: 4-[2-(1,10-phenanthrolin-2-yl)ethynyl]aniline CAS Name: 4-[2-(1,10-phenanthrolin-2-yl)ethynyl]aniline IUPAC Name: 4-[2-(1,10-phenanthrolin-2-yl)ethynyl]aniline Traditional Name: [4-[2-(1,10-phenanthrolin-2-yl)ethynyl]phenyl]amine Formula: C20H13N3 MolecularWeight: 295.33732

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C3=C(C=C2)C=CC(=N3)C#CC4=CC=C(C=C4)N)N=C1

Isomeric SMILES

C1=CC2=C(C3=C(C=C2)C=CC(=N3)C#CC4=CC=C(C=C4)N)N=C1

InChI

InChI=1S/C20H13N3/c21-17-9-3-14(4-10-17)5-11-18-12-8-16-7-6-15-2-1-13-22-19(15)20(16)23-18/h1-4,6-10,12-13H,21H2