methyl 5-methyl-1-(2-methylpropyl)-2-propyl-pyrrole-3-carboxylate

Systemtic Name: methyl 5-methyl-1-(2-methylpropyl)-2-propyl-pyrrole-3-carboxylate Openeye Name: methyl 1-isobutyl-5-methyl-2-propyl-pyrrole-3-carboxylate CAS Name: 5-methyl-1-(2-methylpropyl)-2-propyl-3-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl 5-methyl-1-(2-methylpropyl)-2-propylpyrrole-3-carboxylate Traditional Name: 1-isobutyl-5-methyl-2-propyl-pyrrole-3-carboxylic acid methyl ester Formula: C14H23NO2 MolecularWeight: 237.33792

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=C(N1CC(C)C)C)C(=O)OC

Isomeric SMILES

CCCC1=C(C=C(N1CC(C)C)C)C(=O)OC

InChI

InChI=1S/C14H23NO2/c1-6-7-13-12(14(16)17-5)8-11(4)15(13)9-10(2)3/h8,10H,6-7,9H2,1-5H3