2-methyl-1-(3-methylbutyl)-4-(3-phenoxyphenyl)-5-propyl-pyrrole-3-carboxamide

Systemtic Name: 2-methyl-1-(3-methylbutyl)-4-(3-phenoxyphenyl)-5-propyl-pyrrole-3-carboxamide Openeye Name: 1-isopentyl-2-methyl-4-(3-phenoxyphenyl)-5-propyl-pyrrole-3-carboxamide CAS Name: 2-methyl-1-(3-methylbutyl)-4-(3-phenoxyphenyl)-5-propyl-3-pyrrolecarboxamide IUPAC Name: 2-methyl-1-(3-methylbutyl)-4-(3-phenoxyphenyl)-5-propylpyrrole-3-carboxamide Traditional Name: 1-isoamyl-2-methyl-4-(3-phenoxyphenyl)-5-propyl-pyrrole-3-carboxamide Formula: C26H32N2O2 MolecularWeight: 404.54448

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(=C(N1CCC(C)C)C)C(=O)N)C2=CC(=CC=C2)OC3=CC=CC=C3

Isomeric SMILES

CCCC1=C(C(=C(N1CCC(C)C)C)C(=O)N)C2=CC(=CC=C2)OC3=CC=CC=C3

InChI

InChI=1S/C26H32N2O2/c1-5-10-23-25(24(26(27)29)19(4)28(23)16-15-18(2)3)20-11-9-14-22(17-20)30-21-12-7-6-8-13-21/h6-9,11-14,17-18H,5,10,15-16H2,1-4H3,(H2,27,29)