4-nitro-N-[(E)-[4-(2-phenylethynyl)phenyl]methylideneamino]aniline

Systemtic Name: 4-nitro-N-[(E)-[4-(2-phenylethynyl)phenyl]methylideneamino]aniline Openeye Name: 4-nitro-N-[(E)-[4-(2-phenylethynyl)phenyl]methyleneamino]aniline CAS Name: 4-nitro-N-[(E)-[4-(2-phenylethynyl)phenyl]methylideneamino]aniline IUPAC Name: 4-nitro-N-[(E)-[4-(2-phenylethynyl)phenyl]methylideneamino]aniline Traditional Name: (4-nitrophenyl)-[(E)-[4-(2-phenylethynyl)benzylidene]amino]amine Formula: C21H15N3O2 MolecularWeight: 341.3627

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C#CC2=CC=C(C=C2)C=NNC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C#CC2=CC=C(C=C2)/C=N/NC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H15N3O2/c25-24(26)21-14-12-20(13-15-21)23-22-16-19-10-8-18(9-11-19)7-6-17-4-2-1-3-5-17/h1-5,8-16,23H/b22-16+