2-methyl-1-(3-methylbutyl)-5-pentyl-4-(4-phenylphenyl)pyrrole-3-carboxamide

Systemtic Name: 2-methyl-1-(3-methylbutyl)-5-pentyl-4-(4-phenylphenyl)pyrrole-3-carboxamide Openeye Name: 1-isopentyl-2-methyl-5-pentyl-4-(4-phenylphenyl)pyrrole-3-carboxamide CAS Name: 2-methyl-1-(3-methylbutyl)-5-pentyl-4-(4-phenylphenyl)-3-pyrrolecarboxamide IUPAC Name: 2-methyl-1-(3-methylbutyl)-5-pentyl-4-(4-phenylphenyl)pyrrole-3-carboxamide Traditional Name: 5-amyl-1-isoamyl-2-methyl-4-(4-phenylphenyl)pyrrole-3-carboxamide Formula: C28H36N2O MolecularWeight: 416.59824

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C(C(=C(N1CCC(C)C)C)C(=O)N)C2=CC=C(C=C2)C3=CC=CC=C3

Isomeric SMILES

CCCCCC1=C(C(=C(N1CCC(C)C)C)C(=O)N)C2=CC=C(C=C2)C3=CC=CC=C3

InChI

InChI=1S/C28H36N2O/c1-5-6-8-13-25-27(26(28(29)31)21(4)30(25)19-18-20(2)3)24-16-14-23(15-17-24)22-11-9-7-10-12-22/h7,9-12,14-17,20H,5-6,8,13,18-19H2,1-4H3,(H2,29,31)