2-ethyl-4,5-dimethyl-3-(2-methylpropyl)-1H-pyrrole

Systemtic Name: 2-ethyl-4,5-dimethyl-3-(2-methylpropyl)-1H-pyrrole Openeye Name: 2-ethyl-3-isobutyl-4,5-dimethyl-1H-pyrrole CAS Name: 2-ethyl-4,5-dimethyl-3-(2-methylpropyl)-1H-pyrrole IUPAC Name: 2-ethyl-4,5-dimethyl-3-(2-methylpropyl)-1H-pyrrole Traditional Name: 2-ethyl-3-isobutyl-4,5-dimethyl-1H-pyrrole Formula: C12H21N MolecularWeight: 179.30184

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(N1)C)C)CC(C)C

Isomeric SMILES

CCC1=C(C(=C(N1)C)C)CC(C)C

InChI

InChI=1S/C12H21N/c1-6-12-11(7-8(2)3)9(4)10(5)13-12/h8,13H,6-7H2,1-5H3