2-[4-(diethylamino)phenyl]-4-nitro-isoindole-1,3-dione

Systemtic Name: 2-[4-(diethylamino)phenyl]-4-nitro-isoindole-1,3-dione Openeye Name: 2-[4-(diethylamino)phenyl]-4-nitro-isoindoline-1,3-dione CAS Name: 2-[4-(diethylamino)phenyl]-4-nitroisoindole-1,3-dione IUPAC Name: 2-[4-(diethylamino)phenyl]-4-nitroisoindole-1,3-dione Traditional Name: 2-[4-(diethylamino)phenyl]-4-nitro-isoindoline-1,3-quinone Formula: C18H17N3O4 MolecularWeight: 339.34528

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC=C(C=C1)N2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)C1=CC=C(C=C1)N2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H17N3O4/c1-3-19(4-2)12-8-10-13(11-9-12)20-17(22)14-6-5-7-15(21(24)25)16(14)18(20)23/h5-11H,3-4H2,1-2H3