1-methyl-2-(4-methylphenyl)-4-propyl-pyrrole-3-carboxylic acid

Systemtic Name: 1-methyl-2-(4-methylphenyl)-4-propyl-pyrrole-3-carboxylic acid Openeye Name: 1-methyl-4-propyl-2-(p-tolyl)pyrrole-3-carboxylic acid CAS Name: 1-methyl-2-(4-methylphenyl)-4-propyl-3-pyrrolecarboxylic acid IUPAC Name: 1-methyl-2-(4-methylphenyl)-4-propylpyrrole-3-carboxylic acid Traditional Name: 1-methyl-4-propyl-2-(p-tolyl)pyrrole-3-carboxylic acid Formula: C16H19NO2 MolecularWeight: 257.32756

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CN(C(=C1C(=O)O)C2=CC=C(C=C2)C)C

Isomeric SMILES

CCCC1=CN(C(=C1C(=O)O)C2=CC=C(C=C2)C)C

InChI

InChI=1S/C16H19NO2/c1-4-5-13-10-17(3)15(14(13)16(18)19)12-8-6-11(2)7-9-12/h6-10H,4-5H2,1-3H3,(H,18,19)