N-tert-butyl-3-[3-ethanoyl-5-(4-fluorophenyl)-2-methyl-pyrrol-1-yl]propanamide

Systemtic Name: N-tert-butyl-3-[3-ethanoyl-5-(4-fluorophenyl)-2-methyl-pyrrol-1-yl]propanamide Openeye Name: 3-[3-acetyl-5-(4-fluorophenyl)-2-methyl-pyrrol-1-yl]-N-tert-butyl-propanamide CAS Name: 3-[3-acetyl-5-(4-fluorophenyl)-2-methyl-1-pyrrolyl]-N-tert-butylpropanamide IUPAC Name: 3-[3-acetyl-5-(4-fluorophenyl)-2-methylpyrrol-1-yl]-N-tert-butylpropanamide Traditional Name: 3-[3-acetyl-5-(4-fluorophenyl)-2-methyl-pyrrol-1-yl]-N-tert-butyl-propionamide Formula: C20H25FN2O2 MolecularWeight: 344.423103

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(N1CCC(=O)NC(C)(C)C)C2=CC=C(C=C2)F)C(=O)C

Isomeric SMILES

CC1=C(C=C(N1CCC(=O)NC(C)(C)C)C2=CC=C(C=C2)F)C(=O)C

InChI

InChI=1S/C20H25FN2O2/c1-13-17(14(2)24)12-18(15-6-8-16(21)9-7-15)23(13)11-10-19(25)22-20(3,4)5/h6-9,12H,10-11H2,1-5H3,(H,22,25)