2-(diethylamino)-8-[2-(4-nitrophenyl)ethynyl]naphthalene-1,4-dione

Systemtic Name: 2-(diethylamino)-8-[2-(4-nitrophenyl)ethynyl]naphthalene-1,4-dione Openeye Name: 2-(diethylamino)-8-[2-(4-nitrophenyl)ethynyl]naphthalene-1,4-dione CAS Name: 2-(diethylamino)-8-[2-(4-nitrophenyl)ethynyl]naphthalene-1,4-dione IUPAC Name: 2-(diethylamino)-8-[2-(4-nitrophenyl)ethynyl]naphthalene-1,4-dione Traditional Name: 2-(diethylamino)-8-[2-(4-nitrophenyl)ethynyl]-1,4-naphthoquinone Formula: C22H18N2O4 MolecularWeight: 374.38932

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC(=O)C2=CC=CC(=C2C1=O)C#CC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)C1=CC(=O)C2=CC=CC(=C2C1=O)C#CC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H18N2O4/c1-3-23(4-2)19-14-20(25)18-7-5-6-16(21(18)22(19)26)11-8-15-9-12-17(13-10-15)24(27)28/h5-7,9-10,12-14H,3-4H2,1-2H3