(phenylmethyl) 4-ethyl-3-methyl-5-(2-methylpropyl)-1H-pyrrole-2-carboxylate

Systemtic Name: (phenylmethyl) 4-ethyl-3-methyl-5-(2-methylpropyl)-1H-pyrrole-2-carboxylate Openeye Name: benzyl 4-ethyl-5-isobutyl-3-methyl-1H-pyrrole-2-carboxylate CAS Name: 4-ethyl-3-methyl-5-(2-methylpropyl)-1H-pyrrole-2-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-ethyl-3-methyl-5-(2-methylpropyl)-1H-pyrrole-2-carboxylate Traditional Name: 4-ethyl-5-isobutyl-3-methyl-1H-pyrrole-2-carboxylic acid benzyl ester Formula: C19H25NO2 MolecularWeight: 299.4073

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(NC(=C1C)C(=O)OCC2=CC=CC=C2)CC(C)C

Isomeric SMILES

CCC1=C(NC(=C1C)C(=O)OCC2=CC=CC=C2)CC(C)C

InChI

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