dimethyl 2-butyl-1H-pyrrole-3,4-dicarboxylate

Systemtic Name: dimethyl 2-butyl-1H-pyrrole-3,4-dicarboxylate Openeye Name: dimethyl 2-butyl-1H-pyrrole-3,4-dicarboxylate CAS Name: 2-butyl-1H-pyrrole-3,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-butyl-1H-pyrrole-3,4-dicarboxylate Traditional Name: 2-butyl-1H-pyrrole-3,4-dicarboxylic acid dimethyl ester Formula: C12H17NO4 MolecularWeight: 239.26768

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C(=CN1)C(=O)OC)C(=O)OC

Isomeric SMILES

CCCCC1=C(C(=CN1)C(=O)OC)C(=O)OC

InChI

InChI=1S/C12H17NO4/c1-4-5-6-9-10(12(15)17-3)8(7-13-9)11(14)16-2/h7,13H,4-6H2,1-3H3