2-ethynyl-4-nitro-5-(2-phenylethynyl)aniline

Systemtic Name: 2-ethynyl-4-nitro-5-(2-phenylethynyl)aniline Openeye Name: 2-ethynyl-4-nitro-5-(2-phenylethynyl)aniline CAS Name: 2-ethynyl-4-nitro-5-(2-phenylethynyl)aniline IUPAC Name: 2-ethynyl-4-nitro-5-(2-phenylethynyl)aniline Traditional Name: [2-ethynyl-4-nitro-5-(2-phenylethynyl)phenyl]amine Formula: C16H10N2O2 MolecularWeight: 262.2628

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=C(C=C(C(=C1)[N+](=O)[O-])C#CC2=CC=CC=C2)N

Isomeric SMILES

C#CC1=C(C=C(C(=C1)[N+](=O)[O-])C#CC2=CC=CC=C2)N

InChI

InChI=1S/C16H10N2O2/c1-2-13-11-16(18(19)20)14(10-15(13)17)9-8-12-6-4-3-5-7-12/h1,3-7,10-11H,17H2