diethyl 1-butyl-5-phenyl-pyrrole-2,3-dicarboxylate

Systemtic Name: diethyl 1-butyl-5-phenyl-pyrrole-2,3-dicarboxylate Openeye Name: diethyl 1-butyl-5-phenyl-pyrrole-2,3-dicarboxylate CAS Name: 1-butyl-5-phenylpyrrole-2,3-dicarboxylic acid diethyl ester IUPAC Name: diethyl 1-butyl-5-phenylpyrrole-2,3-dicarboxylate Traditional Name: 1-butyl-5-phenyl-pyrrole-2,3-dicarboxylic acid diethyl ester Formula: C20H25NO4 MolecularWeight: 343.4168

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=CC(=C1C(=O)OCC)C(=O)OCC)C2=CC=CC=C2

Isomeric SMILES

CCCCN1C(=CC(=C1C(=O)OCC)C(=O)OCC)C2=CC=CC=C2

InChI

InChI=1S/C20H25NO4/c1-4-7-13-21-17(15-11-9-8-10-12-15)14-16(19(22)24-5-2)18(21)20(23)25-6-3/h8-12,14H,4-7,13H2,1-3H3