ethyl 3-butyl-2,4-dimethyl-pyrrole-1-carboxylate

Systemtic Name: ethyl 3-butyl-2,4-dimethyl-pyrrole-1-carboxylate Openeye Name: ethyl 3-butyl-2,4-dimethyl-pyrrole-1-carboxylate CAS Name: 3-butyl-2,4-dimethyl-1-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 3-butyl-2,4-dimethylpyrrole-1-carboxylate Traditional Name: 3-butyl-2,4-dimethyl-pyrrole-1-carboxylic acid ethyl ester Formula: C13H21NO2 MolecularWeight: 223.31134

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(N(C=C1C)C(=O)OCC)C

Isomeric SMILES

CCCCC1=C(N(C=C1C)C(=O)OCC)C

InChI

InChI=1S/C13H21NO2/c1-5-7-8-12-10(3)9-14(11(12)4)13(15)16-6-2/h9H,5-8H2,1-4H3