1-ethynyl-4-nitro-2-(3-nitrophenyl)benzene

Systemtic Name: 1-ethynyl-4-nitro-2-(3-nitrophenyl)benzene Openeye Name: 1-ethynyl-4-nitro-2-(3-nitrophenyl)benzene CAS Name: 1-ethynyl-4-nitro-2-(3-nitrophenyl)benzene IUPAC Name: 1-ethynyl-4-nitro-2-(3-nitrophenyl)benzene Traditional Name: 1-ethynyl-4-nitro-2-(3-nitrophenyl)benzene Formula: C14H8N2O4 MolecularWeight: 268.22432

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H8N2O4/c1-2-10-6-7-13(16(19)20)9-14(10)11-4-3-5-12(8-11)15(17)18/h1,3-9H