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

Systemtic Name: 1-cyclooctyl-2-methyl-5-pentyl-4-(3-phenoxyphenyl)pyrrole-3-carboxamide Openeye Name: 1-cyclooctyl-2-methyl-5-pentyl-4-(3-phenoxyphenyl)pyrrole-3-carboxamide CAS Name: 1-cyclooctyl-2-methyl-5-pentyl-4-(3-phenoxyphenyl)-3-pyrrolecarboxamide IUPAC Name: 1-cyclooctyl-2-methyl-5-pentyl-4-(3-phenoxyphenyl)pyrrole-3-carboxamide Traditional Name: 5-amyl-1-cyclooctyl-2-methyl-4-(3-phenoxyphenyl)pyrrole-3-carboxamide Formula: C31H40N2O2 MolecularWeight: 472.6615

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C(C(=C(N1C2CCCCCCC2)C)C(=O)N)C3=CC(=CC=C3)OC4=CC=CC=C4

Isomeric SMILES

CCCCCC1=C(C(=C(N1C2CCCCCCC2)C)C(=O)N)C3=CC(=CC=C3)OC4=CC=CC=C4

InChI

InChI=1S/C31H40N2O2/c1-3-4-9-21-28-30(24-15-14-20-27(22-24)35-26-18-12-8-13-19-26)29(31(32)34)23(2)33(28)25-16-10-6-5-7-11-17-25/h8,12-15,18-20,22,25H,3-7,9-11,16-17,21H2,1-2H3,(H2,32,34)