ethyl 4-ethyl-5-methyl-3-propyl-1H-pyrrole-2-carboxylate

Systemtic Name: ethyl 4-ethyl-5-methyl-3-propyl-1H-pyrrole-2-carboxylate Openeye Name: ethyl 4-ethyl-5-methyl-3-propyl-1H-pyrrole-2-carboxylate CAS Name: 4-ethyl-5-methyl-3-propyl-1H-pyrrole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 4-ethyl-5-methyl-3-propyl-1H-pyrrole-2-carboxylate Traditional Name: 4-ethyl-5-methyl-3-propyl-1H-pyrrole-2-carboxylic acid ethyl ester Formula: C13H21NO2 MolecularWeight: 223.31134

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(NC(=C1CC)C)C(=O)OCC

Isomeric SMILES

CCCC1=C(NC(=C1CC)C)C(=O)OCC

InChI

InChI=1S/C13H21NO2/c1-5-8-11-10(6-2)9(4)14-12(11)13(15)16-7-3/h14H,5-8H2,1-4H3