N-(1-cyanocyclohexyl)-N-methyl-2-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]ethanamide

Systemtic Name: N-(1-cyanocyclohexyl)-N-methyl-2-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]ethanamide Openeye Name: N-(1-cyanocyclohexyl)-N-methyl-2-(4-nitro-1,3-dioxo-isoindolin-2-yl)acetamide CAS Name: N-(1-cyanocyclohexyl)-N-methyl-2-(4-nitro-1,3-dioxo-2-isoindolyl)acetamide IUPAC Name: N-(1-cyanocyclohexyl)-N-methyl-2-(4-nitro-1,3-dioxoisoindol-2-yl)acetamide Traditional Name: N-(1-cyanocyclohexyl)-2-(1,3-diketo-4-nitro-isoindolin-2-yl)-N-methyl-acetamide Formula: C18H18N4O5 MolecularWeight: 370.35932

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C(=O)CN1C(=O)C2=C(C1=O)C(=CC=C2)[N+](=O)[O-])C3(CCCCC3)C#N

Isomeric SMILES

CN(C(=O)CN1C(=O)C2=C(C1=O)C(=CC=C2)[N+](=O)[O-])C3(CCCCC3)C#N

InChI

InChI=1S/C18H18N4O5/c1-20(18(11-19)8-3-2-4-9-18)14(23)10-21-16(24)12-6-5-7-13(22(26)27)15(12)17(21)25/h5-7H,2-4,8-10H2,1H3