O2-tert-butyl O4-(phenylmethyl) 3-ethyl-5-methanoyl-1H-pyrrole-2,4-dicarboxylate

Systemtic Name: O2-tert-butyl O4-(phenylmethyl) 3-ethyl-5-methanoyl-1H-pyrrole-2,4-dicarboxylate Openeye Name: O4-benzyl O2-tert-butyl 3-ethyl-5-formyl-1H-pyrrole-2,4-dicarboxylate CAS Name: 3-ethyl-5-formyl-1H-pyrrole-2,4-dicarboxylic acid O2-tert-butyl ester O4-(phenylmethyl) ester IUPAC Name: 4-O-benzyl 2-O-tert-butyl 3-ethyl-5-formyl-1H-pyrrole-2,4-dicarboxylate Traditional Name: 3-ethyl-5-formyl-1H-pyrrole-2,4-dicarboxylic acid O4-benzyl ester O2-tert-butyl ester Formula: C20H23NO5 MolecularWeight: 357.40032

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(NC(=C1C(=O)OCC2=CC=CC=C2)C=O)C(=O)OC(C)(C)C

Isomeric SMILES

CCC1=C(NC(=C1C(=O)OCC2=CC=CC=C2)C=O)C(=O)OC(C)(C)C

InChI

InChI=1S/C20H23NO5/c1-5-14-16(18(23)25-12-13-9-7-6-8-10-13)15(11-22)21-17(14)19(24)26-20(2,3)4/h6-11,21H,5,12H2,1-4H3