5-butyl-1-[2-(3,4-dimethoxyphenyl)ethyl]-2-methyl-4-phenyl-pyrrole-3-carboxamide

Systemtic Name: 5-butyl-1-[2-(3,4-dimethoxyphenyl)ethyl]-2-methyl-4-phenyl-pyrrole-3-carboxamide Openeye Name: 5-butyl-1-[2-(3,4-dimethoxyphenyl)ethyl]-2-methyl-4-phenyl-pyrrole-3-carboxamide CAS Name: 5-butyl-1-[2-(3,4-dimethoxyphenyl)ethyl]-2-methyl-4-phenyl-3-pyrrolecarboxamide IUPAC Name: 5-butyl-1-[2-(3,4-dimethoxyphenyl)ethyl]-2-methyl-4-phenylpyrrole-3-carboxamide Traditional Name: 5-butyl-1-homoveratryl-2-methyl-4-phenyl-pyrrole-3-carboxamide Formula: C26H32N2O3 MolecularWeight: 420.54388

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C(=C(N1CCC2=CC(=C(C=C2)OC)OC)C)C(=O)N)C3=CC=CC=C3

Isomeric SMILES

CCCCC1=C(C(=C(N1CCC2=CC(=C(C=C2)OC)OC)C)C(=O)N)C3=CC=CC=C3

InChI

InChI=1S/C26H32N2O3/c1-5-6-12-21-25(20-10-8-7-9-11-20)24(26(27)29)18(2)28(21)16-15-19-13-14-22(30-3)23(17-19)31-4/h7-11,13-14,17H,5-6,12,15-16H2,1-4H3,(H2,27,29)