5-butyl-4-(4-cyanophenyl)-1-cyclooctyl-2-methyl-pyrrole-3-carboxamide

Systemtic Name: 5-butyl-4-(4-cyanophenyl)-1-cyclooctyl-2-methyl-pyrrole-3-carboxamide Openeye Name: 5-butyl-4-(4-cyanophenyl)-1-cyclooctyl-2-methyl-pyrrole-3-carboxamide CAS Name: 5-butyl-4-(4-cyanophenyl)-1-cyclooctyl-2-methyl-3-pyrrolecarboxamide IUPAC Name: 5-butyl-4-(4-cyanophenyl)-1-cyclooctyl-2-methylpyrrole-3-carboxamide Traditional Name: 5-butyl-4-(4-cyanophenyl)-1-cyclooctyl-2-methyl-pyrrole-3-carboxamide Formula: C25H33N3O MolecularWeight: 391.54902

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C(=C(N1C2CCCCCCC2)C)C(=O)N)C3=CC=C(C=C3)C#N

Isomeric SMILES

CCCCC1=C(C(=C(N1C2CCCCCCC2)C)C(=O)N)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C25H33N3O/c1-3-4-12-22-24(20-15-13-19(17-26)14-16-20)23(25(27)29)18(2)28(22)21-10-8-6-5-7-9-11-21/h13-16,21H,3-12H2,1-2H3,(H2,27,29)