N1'-(1-cyanoethyl)-5-ethyl-6-nitro-6-phenyl-cyclohexa-2,4-diene-1,1-dicarboxamide

Systemtic Name: N1'-(1-cyanoethyl)-5-ethyl-6-nitro-6-phenyl-cyclohexa-2,4-diene-1,1-dicarboxamide Openeye Name: N1'-(1-cyanoethyl)-5-ethyl-6-nitro-6-phenyl-cyclohexa-2,4-diene-1,1-dicarboxamide CAS Name: N1'-(1-cyanoethyl)-5-ethyl-6-nitro-6-phenylcyclohexa-2,4-diene-1,1-dicarboxamide IUPAC Name: 1-N'-(1-cyanoethyl)-5-ethyl-6-nitro-6-phenylcyclohexa-2,4-diene-1,1-dicarboxamide Traditional Name: N'-(1-cyanoethyl)-5-ethyl-6-nitro-6-phenyl-cyclohexa-2,4-diene-1,1-dicarboxamide Formula: C19H20N4O4 MolecularWeight: 368.3865

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(C1(C2=CC=CC=C2)[N+](=O)[O-])(C(=O)N)C(=O)NC(C)C#N

Isomeric SMILES

CCC1=CC=CC(C1(C2=CC=CC=C2)[N+](=O)[O-])(C(=O)N)C(=O)NC(C)C#N

InChI

InChI=1S/C19H20N4O4/c1-3-14-10-7-11-18(16(21)24,17(25)22-13(2)12-20)19(14,23(26)27)15-8-5-4-6-9-15/h4-11,13H,3H2,1-2H3,(H2,21,24)(H,22,25)