5-tert-butyl-1-(2-methylpropyl)-2-phenyl-pyrrole-3-carboxylic acid

Systemtic Name: 5-tert-butyl-1-(2-methylpropyl)-2-phenyl-pyrrole-3-carboxylic acid Openeye Name: 5-tert-butyl-1-isobutyl-2-phenyl-pyrrole-3-carboxylic acid CAS Name: 5-tert-butyl-1-(2-methylpropyl)-2-phenyl-3-pyrrolecarboxylic acid IUPAC Name: 5-tert-butyl-1-(2-methylpropyl)-2-phenylpyrrole-3-carboxylic acid Traditional Name: 5-tert-butyl-1-isobutyl-2-phenyl-pyrrole-3-carboxylic acid Formula: C19H25NO2 MolecularWeight: 299.4073

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=CC(=C1C2=CC=CC=C2)C(=O)O)C(C)(C)C

Isomeric SMILES

CC(C)CN1C(=CC(=C1C2=CC=CC=C2)C(=O)O)C(C)(C)C

InChI

InChI=1S/C19H25NO2/c1-13(2)12-20-16(19(3,4)5)11-15(18(21)22)17(20)14-9-7-6-8-10-14/h6-11,13H,12H2,1-5H3,(H,21,22)