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

Systemtic Name: 4-(4-tert-butylphenyl)-2-methyl-1-(3-methylbutyl)-5-pentyl-pyrrole-3-carboxamide Openeye Name: 4-(4-tert-butylphenyl)-1-isopentyl-2-methyl-5-pentyl-pyrrole-3-carboxamide CAS Name: 4-(4-tert-butylphenyl)-2-methyl-1-(3-methylbutyl)-5-pentyl-3-pyrrolecarboxamide IUPAC Name: 4-(4-tert-butylphenyl)-2-methyl-1-(3-methylbutyl)-5-pentylpyrrole-3-carboxamide Traditional Name: 5-amyl-4-(4-tert-butylphenyl)-1-isoamyl-2-methyl-pyrrole-3-carboxamide Formula: C26H40N2O MolecularWeight: 396.6086

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H40N2O/c1-8-9-10-11-22-24(20-12-14-21(15-13-20)26(5,6)7)23(25(27)29)19(4)28(22)17-16-18(2)3/h12-15,18H,8-11,16-17H2,1-7H3,(H2,27,29)