N1'-(cyanomethyl)-5-ethyl-6-naphthalen-2-yl-6-nitro-cyclohexa-2,4-diene-1,1-dicarboxamide

Systemtic Name: N1'-(cyanomethyl)-5-ethyl-6-naphthalen-2-yl-6-nitro-cyclohexa-2,4-diene-1,1-dicarboxamide Openeye Name: N1'-(cyanomethyl)-5-ethyl-6-(2-naphthyl)-6-nitro-cyclohexa-2,4-diene-1,1-dicarboxamide CAS Name: N1'-(cyanomethyl)-5-ethyl-6-(2-naphthalenyl)-6-nitrocyclohexa-2,4-diene-1,1-dicarboxamide IUPAC Name: 1-N'-(cyanomethyl)-5-ethyl-6-naphthalen-2-yl-6-nitrocyclohexa-2,4-diene-1,1-dicarboxamide Traditional Name: N'-(cyanomethyl)-5-ethyl-6-(2-naphthyl)-6-nitro-cyclohexa-2,4-diene-1,1-dicarboxamide Formula: C22H20N4O4 MolecularWeight: 404.4186

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(C1(C2=CC3=CC=CC=C3C=C2)[N+](=O)[O-])(C(=O)N)C(=O)NCC#N

Isomeric SMILES

CCC1=CC=CC(C1(C2=CC3=CC=CC=C3C=C2)[N+](=O)[O-])(C(=O)N)C(=O)NCC#N

InChI

InChI=1S/C22H20N4O4/c1-2-17-8-5-11-21(19(24)27,20(28)25-13-12-23)22(17,26(29)30)18-10-9-15-6-3-4-7-16(15)14-18/h3-11,14H,2,13H2,1H3,(H2,24,27)(H,25,28)