5-butyl-1-[2-(4-hydroxyphenyl)ethyl]-2-methyl-4-quinolin-2-yl-pyrrole-3-carboxamide

Systemtic Name: 5-butyl-1-[2-(4-hydroxyphenyl)ethyl]-2-methyl-4-quinolin-2-yl-pyrrole-3-carboxamide Openeye Name: 5-butyl-1-[2-(4-hydroxyphenyl)ethyl]-2-methyl-4-(2-quinolyl)pyrrole-3-carboxamide CAS Name: 5-butyl-1-[2-(4-hydroxyphenyl)ethyl]-2-methyl-4-(2-quinolinyl)-3-pyrrolecarboxamide IUPAC Name: 5-butyl-1-[2-(4-hydroxyphenyl)ethyl]-2-methyl-4-quinolin-2-ylpyrrole-3-carboxamide Traditional Name: 5-butyl-1-[2-(4-hydroxyphenyl)ethyl]-2-methyl-4-(2-quinolyl)pyrrole-3-carboxamide Formula: C27H29N3O2 MolecularWeight: 427.53806

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C(=C(N1CCC2=CC=C(C=C2)O)C)C(=O)N)C3=NC4=CC=CC=C4C=C3

Isomeric SMILES

CCCCC1=C(C(=C(N1CCC2=CC=C(C=C2)O)C)C(=O)N)C3=NC4=CC=CC=C4C=C3

InChI

InChI=1S/C27H29N3O2/c1-3-4-9-24-26(23-15-12-20-7-5-6-8-22(20)29-23)25(27(28)32)18(2)30(24)17-16-19-10-13-21(31)14-11-19/h5-8,10-15,31H,3-4,9,16-17H2,1-2H3,(H2,28,32)