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

Systemtic Name: N1'-(cyanomethyl)-5-ethyl-6-fluoranyl-6-phenyl-cyclohexa-2,4-diene-1,1-dicarboxamide Openeye Name: N1'-(cyanomethyl)-5-ethyl-6-fluoro-6-phenyl-cyclohexa-2,4-diene-1,1-dicarboxamide CAS Name: N1'-(cyanomethyl)-5-ethyl-6-fluoro-6-phenylcyclohexa-2,4-diene-1,1-dicarboxamide IUPAC Name: 1-N'-(cyanomethyl)-5-ethyl-6-fluoro-6-phenylcyclohexa-2,4-diene-1,1-dicarboxamide Traditional Name: N'-(cyanomethyl)-5-ethyl-6-fluoro-6-phenyl-cyclohexa-2,4-diene-1,1-dicarboxamide Formula: C18H18FN3O2 MolecularWeight: 327.352823

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(C1(C2=CC=CC=C2)F)(C(=O)N)C(=O)NCC#N

Isomeric SMILES

CCC1=CC=CC(C1(C2=CC=CC=C2)F)(C(=O)N)C(=O)NCC#N

InChI

InChI=1S/C18H18FN3O2/c1-2-13-9-6-10-17(15(21)23,16(24)22-12-11-20)18(13,19)14-7-4-3-5-8-14/h3-10H,2,12H2,1H3,(H2,21,23)(H,22,24)