3-cyano-1-(2-ethylphenyl)-N-hexyl-pyrrole-2-carboxamide

Systemtic Name: 3-cyano-1-(2-ethylphenyl)-N-hexyl-pyrrole-2-carboxamide Openeye Name: 3-cyano-1-(2-ethylphenyl)-N-hexyl-pyrrole-2-carboxamide CAS Name: 3-cyano-1-(2-ethylphenyl)-N-hexyl-2-pyrrolecarboxamide IUPAC Name: 3-cyano-1-(2-ethylphenyl)-N-hexylpyrrole-2-carboxamide Traditional Name: 3-cyano-1-(2-ethylphenyl)-N-hexyl-pyrrole-2-carboxamide Formula: C20H25N3O MolecularWeight: 323.432

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC(=O)C1=C(C=CN1C2=CC=CC=C2CC)C#N

Isomeric SMILES

CCCCCCNC(=O)C1=C(C=CN1C2=CC=CC=C2CC)C#N

InChI

InChI=1S/C20H25N3O/c1-3-5-6-9-13-22-20(24)19-17(15-21)12-14-23(19)18-11-8-7-10-16(18)4-2/h7-8,10-12,14H,3-6,9,13H2,1-2H3,(H,22,24)