5-[2-(4-nitrophenyl)ethynyl]naphthalene-1,4-dione

Systemtic Name: 5-[2-(4-nitrophenyl)ethynyl]naphthalene-1,4-dione Openeye Name: 5-[2-(4-nitrophenyl)ethynyl]naphthalene-1,4-dione CAS Name: 5-[2-(4-nitrophenyl)ethynyl]naphthalene-1,4-dione IUPAC Name: 5-[2-(4-nitrophenyl)ethynyl]naphthalene-1,4-dione Traditional Name: 5-[2-(4-nitrophenyl)ethynyl]-1,4-naphthoquinone Formula: C18H9NO4 MolecularWeight: 303.26836

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C2C(=O)C=CC(=O)C2=C1)C#CC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C2C(=O)C=CC(=O)C2=C1)C#CC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H9NO4/c20-16-10-11-17(21)18-13(2-1-3-15(16)18)7-4-12-5-8-14(9-6-12)19(22)23/h1-3,5-6,8-11H