N-[4,4-dimethyl-8-nitro-1,3-bis(oxidanylidene)-7-phenyl-isoquinolin-2-yl]ethanamide

Systemtic Name: N-[4,4-dimethyl-8-nitro-1,3-bis(oxidanylidene)-7-phenyl-isoquinolin-2-yl]ethanamide Openeye Name: N-(4,4-dimethyl-8-nitro-1,3-dioxo-7-phenyl-2-isoquinolyl)acetamide CAS Name: N-(4,4-dimethyl-8-nitro-1,3-dioxo-7-phenyl-2-isoquinolinyl)acetamide IUPAC Name: N-(4,4-dimethyl-8-nitro-1,3-dioxo-7-phenylisoquinolin-2-yl)acetamide Traditional Name: N-(1,3-diketo-4,4-dimethyl-8-nitro-7-phenyl-2-isoquinolyl)acetamide Formula: C19H17N3O5 MolecularWeight: 367.35538

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NN1C(=O)C2=C(C=CC(=C2[N+](=O)[O-])C3=CC=CC=C3)C(C1=O)(C)C

Isomeric SMILES

CC(=O)NN1C(=O)C2=C(C=CC(=C2[N+](=O)[O-])C3=CC=CC=C3)C(C1=O)(C)C

InChI

InChI=1S/C19H17N3O5/c1-11(23)20-21-17(24)15-14(19(2,3)18(21)25)10-9-13(16(15)22(26)27)12-7-5-4-6-8-12/h4-10H,1-3H3,(H,20,23)