4-(4-bromophenyl)-1-cyclooctyl-2-methyl-5-pentyl-pyrrole-3-carboxamide

Systemtic Name: 4-(4-bromophenyl)-1-cyclooctyl-2-methyl-5-pentyl-pyrrole-3-carboxamide Openeye Name: 4-(4-bromophenyl)-1-cyclooctyl-2-methyl-5-pentyl-pyrrole-3-carboxamide CAS Name: 4-(4-bromophenyl)-1-cyclooctyl-2-methyl-5-pentyl-3-pyrrolecarboxamide IUPAC Name: 4-(4-bromophenyl)-1-cyclooctyl-2-methyl-5-pentylpyrrole-3-carboxamide Traditional Name: 5-amyl-4-(4-bromophenyl)-1-cyclooctyl-2-methyl-pyrrole-3-carboxamide Formula: C25H35BrN2O MolecularWeight: 459.4622

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C(C(=C(N1C2CCCCCCC2)C)C(=O)N)C3=CC=C(C=C3)Br

Isomeric SMILES

CCCCCC1=C(C(=C(N1C2CCCCCCC2)C)C(=O)N)C3=CC=C(C=C3)Br

InChI

InChI=1S/C25H35BrN2O/c1-3-4-8-13-22-24(19-14-16-20(26)17-15-19)23(25(27)29)18(2)28(22)21-11-9-6-5-7-10-12-21/h14-17,21H,3-13H2,1-2H3,(H2,27,29)