1-butyl-5-tert-butyl-2-(4-chlorophenyl)pyrrole-3-carboxylic acid

Systemtic Name: 1-butyl-5-tert-butyl-2-(4-chlorophenyl)pyrrole-3-carboxylic acid Openeye Name: 1-butyl-5-tert-butyl-2-(4-chlorophenyl)pyrrole-3-carboxylic acid CAS Name: 1-butyl-5-tert-butyl-2-(4-chlorophenyl)-3-pyrrolecarboxylic acid IUPAC Name: 1-butyl-5-tert-butyl-2-(4-chlorophenyl)pyrrole-3-carboxylic acid Traditional Name: 1-butyl-5-tert-butyl-2-(4-chlorophenyl)pyrrole-3-carboxylic acid Formula: C19H24ClNO2 MolecularWeight: 333.85236

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=CC(=C1C2=CC=C(C=C2)Cl)C(=O)O)C(C)(C)C

Isomeric SMILES

CCCCN1C(=CC(=C1C2=CC=C(C=C2)Cl)C(=O)O)C(C)(C)C

InChI

InChI=1S/C19H24ClNO2/c1-5-6-11-21-16(19(2,3)4)12-15(18(22)23)17(21)13-7-9-14(20)10-8-13/h7-10,12H,5-6,11H2,1-4H3,(H,22,23)